SCHEMBL1763640

SCHEMBL1763640

CC(C)(C)OC(=O)NC(CC1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.50
MAPK1 P28482 1/20 0.47
MDM2 Q00987 1/20 0.47
BACE1 P56817 1/20 0.47
MDM4 O15151 2/20 0.46
TP53 P04637 2/20 0.46
YAP1 P46937 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
TLR2 O60603 1/20 0.42
TLR1 Q15399 1/20 0.42
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41

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
SCHEMBL31627392 0.94 BACE1 (0.53) IDO1MAPK1MDM2BACE1MDM4
SCHEMBL25356332 0.94 BACE1 (0.53) IDO1MAPK1MDM2BACE1MDM4
SCHEMBL5434114 0.94 BACE1 (0.53) IDO1MAPK1MDM2BACE1MDM4
SCHEMBL25355242 0.94 BACE1 (0.53) IDO1MAPK1MDM2BACE1MDM4
SCHEMBL25356064 0.85 MDM4 (0.48) IDO1MDM2BACE1MDM4TP53
SCHEMBL25356055 0.85 MDM4 (0.48) IDO1MDM2BACE1MDM4TP53
SCHEMBL25356058 0.85 MDM4 (0.48) IDO1MDM2BACE1MDM4TP53
SCHEMBL30639799 0.85 BACE1 (0.52) IDO1MDM2BACE1MDM4TP53
SCHEMBL30639789 0.85 BACE1 (0.52) IDO1MDM2BACE1MDM4TP53
SCHEMBL26105252 0.85 BACE1 (0.52) IDO1MDM2BACE1MDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10913769-B2 Synthetic peptide amides and dimers thereof CARA THERAPEUTICS, INC. (US) 2021-02-09 US disclosed
US-20190177365-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2019-06-13 US disclosed
US-10017536-B2 Synthetic peptide amides and dimers thereof CARA THERAPEUTICS, INC. (US) 2018-07-10 US disclosed
US-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2016-12-29 US disclosed
US-9334305-B2 Synthetic peptide amides and dimers thereof CARA THERAPEUTICS, INC. (US) 2016-05-10 US disclosed
US-20140357579-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF VIFOR FRESENIUS MEDICAL CARE RENAL PHARMA LTD (CH) 2014-12-04 US disclosed
CN-101535336-B Synthetic phthalamides and dimers thereof CARA THERAPEUTICS INC 2014-04-02 CN disclosed
US-8536131-B2 Synthetic peptide amides and dimers thereof CARA THERAPEUTICS, INC. (US) 2013-09-17 US disclosed
US-8486894-B2 Synthetic peptide amides and dimeric forms thereof CARA THERAPEUTICS, INC. (US) 2013-07-16 US disclosed
EP-2079756-B1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS INC (US) 2012-10-17 EP disclosed
US-20110257105-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2011-10-20 US disclosed
US-20110118186-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2011-05-19 US disclosed
US-7842662-B2 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) 2010-11-30 US disclosed
US-7713937-B2 Synthetic peptide amides and dimeric forms thereof CARA THERAPEUTICS, INC. (US) 2010-05-11 US disclosed
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2010-03-25 US disclosed
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 disclosed
CN-101535336-A Synthetic phthalamides and dimers thereof SYNTHETIC PEPTIDE AMIDES AND D (US) 2009-09-16 CN disclosed
EP-2079756-A2 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF Cara Therapeutics, Inc. (US) 2009-07-22 EP disclosed
US-20090156508-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2009-06-18 US disclosed
WO-2008060552-A2 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2008-05-22 WO disclosed

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

For each of this compound's patents that has machine-readable text (10 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-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRD1, OPRM1 IDO1 303/4885MAPK1 1876/4885MDM2 4041/4885
US-20090156508-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRM1, OPRL1 IDO1 347/4885MAPK1 1634/4885MDM2 4499/4885
US-20110118186-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRM1, OPRL1 IDO1 347/4885MAPK1 1634/4885MDM2 4499/4885
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 IDO1 117/4885MAPK1 767/4885MDM2 3924/4885
US-10913769-B2 Synthetic peptide amides and dimers thereof OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885
US-20140357579-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885
US-20110257105-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885
US-10017536-B2 Synthetic peptide amides and dimers thereof OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885
US-20190177365-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 IDO1 614/4885MAPK1 1605/4885MDM2 3623/4885

“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.