SCHEMBL1763708

SCHEMBL1763708

NN1CCC(CC(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.44
▸ ENPEP Q07075 1/20 0.44
▸ SLC6A12 P48065 5/20 0.42
▸ SLC6A11 P48066 5/20 0.42
▸ SLC6A13 Q9NSD5 5/20 0.42
▸ SLC6A1 P30531 2/20 0.42
▸ GABRA5 P31644 2/20 0.42
▸ GABRB2 P47870 2/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRR1 P24046 1/20 0.42
▸ GABRA4 P48169 1/20 0.42
▸ ITGB3 P05106 5/20 0.39
▸ ITGA2B P08514 5/20 0.39
▸ FFAR4 Q5NUL3 3/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6179700 0.78 ITGB3 (0.45) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL3833697 0.77 SLC6A1 (0.42) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL8863354 0.77 SLC6A1 (0.42) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL13308026 0.77 SLC6A1 (0.42) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL1243284 0.77 SLC6A1 (0.42) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL18123287 0.77 SLC6A1 (0.42) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL805205 0.77 NCF1 (0.48) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL24483431 0.77 ANPEP (0.56) ANPEPENPEPSLC6A12SLC6A11SLC6A13
SCHEMBL74792 0.77 — —
SCHEMBL24197646 0.77 ANPEP (0.56) ANPEPENPEPSLC6A12SLC6A11SLC6A13

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220125781-A1 Methods and Compositions for Treating Vasomotor Symptoms UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION 2022-04-28 — — US claimed
US-20210030745-A9 Methods and Compositions for Treating Vasomotor Symptoms ACER THERAPEUTICS INC. 2021-02-04 — — US claimed
US-20190255037-A1 Methods and Compositions for Treating Vasomotor Symptoms UNIV WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2019-08-22 — — US claimed
US-20190177365-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2019-06-13 — — US claimed
US-10138270-B2 Synthetic peptide amides CARA THERAPEUTICS, INC. (US) 2018-11-27 — — US claimed
US-10017536-B2 Synthetic peptide amides and dimers thereof CARA THERAPEUTICS, INC. (US) 2018-07-10 — — US claimed
US-20180028594-A1 PERIPHERAL KAPPA OPIOID RECEPTOR AGONISTS FOR HARD TISSUE PAIN CARA THERAPEUTICS, INC. (US) 2018-02-01 — — US claimed
US-20170231979-A1 Methods and Compositions for Treating Vasomotor Symptoms UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION 2017-08-17 — — US claimed
US-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2016-12-29 — — US claimed
US-20160362450-A1 SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS, INC. (US) 2016-12-15 — — US claimed
US-7727963-B2 Synthetic peptide amides CARA THERAPEUTICS, INC. (US) 2010-06-01 — — US claimed
US-7713937-B2 Synthetic peptide amides and dimeric forms thereof CARA THERAPEUTICS, INC. (US) 2010-05-11 — — US claimed
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2010-03-25 — — US claimed
US-20090264373-A1 of kappa opioid receptor and agonists thereof, exhibit low P450 CYP inhibition and low penetration into the brain; visceral pain, neuropathic pain, hyperalgesia, irritabile bowel syndrome, ocular and otic inflammation, pruritis, edema, hyponatremia, hypokalemia, ileus, tussis and glaucoma CARA THERAPEUTICS, INC. (US) 2009-10-22 — — US claimed
EP-2079756-A2 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF Cara Therapeutics, Inc. (US) 2009-07-22 — — EP claimed
US-20090156508-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2009-06-18 — — US claimed
EP-2064228-A2 SYNTHETIC PEPTIDE AMIDES Cara Therapeutics, Inc. (US) 2009-06-03 — — EP claimed
US-20090075907-A1 SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS, INC. (US) 2009-03-19 — — US claimed
WO-2008060552-A2 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2008-05-22 — — WO claimed
WO-2008057608-A2 SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS, INC. (US) 2008-05-15 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210030745-A9 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A ANPEP 3192/4885ENPEP 2236/4885SLC6A12 1017/4885
US-20190255037-A1 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A ANPEP 3192/4885ENPEP 2236/4885SLC6A12 1017/4885
US-10138270-B2 Synthetic peptide amides VIP, OPRK1, OPRL1 ANPEP 709/4885ENPEP 836/4885SLC6A12 781/4885
US-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 ANPEP 96/4885ENPEP 171/4885SLC6A12 4146/4885
US-20180028594-A1 PERIPHERAL KAPPA OPIOID RECEPTOR AGONISTS FOR HARD TISSUE PAIN OPRK1, OPRL1, OPRD1 ANPEP 297/4885ENPEP 572/4885SLC6A12 662/4885
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRD1, OPRM1 ANPEP 58/4885ENPEP 50/4885SLC6A12 3695/4885
US-20090156508-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRM1, OPRL1 ANPEP 47/4885ENPEP 50/4885SLC6A12 3347/4885
US-20090075907-A1 SYNTHETIC PEPTIDE AMIDES VIP, OPRK1, OPRL1 ANPEP 709/4885ENPEP 836/4885SLC6A12 781/4885
US-20090264373-A1 of kappa opioid receptor and agonists thereof, exhibit low P450 CYP inhibition and low penetration into the brain; visceral pain, neuropathic pain, hyperalgesia, irritabile bowel syndrome, ocular and otic inflammation, pruritis, edema, hyponatremia, hypokalemia, ileus, tussis and glaucoma OPRK1, OPRD1, OGFR ANPEP 1267/4885ENPEP 1564/4885SLC6A12 319/4885
US-20160362450-A1 SYNTHETIC PEPTIDE AMIDES VIP, OPRK1, OPRL1 ANPEP 709/4885ENPEP 836/4885SLC6A12 781/4885
US-20220125781-A1 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A ANPEP 3192/4885ENPEP 2236/4885SLC6A12 1017/4885
US-20170231979-A1 Methods and Compositions for Treating Vasomotor Symptoms VASP, PDE3A, PDE2A ANPEP 3192/4885ENPEP 2236/4885SLC6A12 1017/4885
US-10017536-B2 Synthetic peptide amides and dimers thereof OPRK1, OPRL1, OPRM1 ANPEP 96/4885ENPEP 171/4885SLC6A12 4146/4885
US-20190177365-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 ANPEP 96/4885ENPEP 171/4885SLC6A12 4146/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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