SCHEMBL322740

SCHEMBL322740

COC1CCC(CC(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.43
ENPEP Q07075 1/20 0.43
SLC6A1 P30531 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRB2 P47870 2/20 0.41
SLC6A12 P48065 2/20 0.41
SLC6A11 P48066 2/20 0.41
SLC6A13 Q9NSD5 2/20 0.41
GABRA1 P14867 1/20 0.41
GABRR1 P24046 1/20 0.41
GABRA4 P48169 1/20 0.41
GRM1 Q13255 1/20 0.39
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ACSL1 P33121 1/20 0.36
DAO P14920 1/20 0.35
FFAR4 Q5NUL3 5/20 0.35
KCNQ3 O43525 2/20 0.34

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
SCHEMBL322739 1.00 ANPEP (0.43) ANPEPENPEPSLC6A1GABRA5GABRB2
Potassium SCHEMBL607194 0.98 ANPEP (0.42) ANPEPENPEPSLC6A1GABRA5GABRB2
SCHEMBL607192 0.98 ANPEP (0.42) ANPEPENPEPSLC6A1GABRA5GABRB2
Hydrochloric Acid SCHEMBL1710560 0.96 ANPEP (0.41) ANPEPENPEPSLC6A1GABRA5GABRB2
Hydrochloric Acid SCHEMBL1860705 0.96 ANPEP (0.41) ANPEPENPEPSLC6A1GABRA5GABRB2
SCHEMBL15859443 0.86 SLC6A12 (0.37) ANPEPENPEPSLC6A1GABRA5GABRB2
SCHEMBL606928 0.86 SLC6A12 (0.37) ANPEPENPEPSLC6A1GABRA5GABRB2
SCHEMBL337044 0.81 GRM1 (0.38) ANPEPENPEPGRM1POLBTDP1
SCHEMBL337453 0.81 BRD4 (0.43) GRM1ALDH1A1DAOKCNQ3KCNQ2
SCHEMBL10086748 0.81 BRD4 (0.43) GRM1ALDH1A1DAOKCNQ3KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024038282-A1 2-AZA- AND 2-OXABICYCLO[2.1.1]HEXANE DERIVATIVES AS FACTOR XIIA ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2024-02-22 WO disclosed
US-20210070708-A1 Pharmaceutically Active Compounds BERGENBIO ASA (NO) 2021-03-11 US disclosed
US-10766861-B2 Pharmaceutically active compounds BERGENBIO ASA (NO) 2020-09-08 US disclosed
US-10336702-B2 Pharmaceutically active compounds BERGENBIO ASA (NO) 2019-07-02 US disclosed
US-20180029985-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS BERGENBIO AS (NO) 2018-02-01 US disclosed
EP-3240784-A2 INHIBITORS OF AKT KINASE BerGenBio ASA (NO) 2017-11-08 EP disclosed
US-20170298001-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF CORSAIR PHARMA INC (US) 2017-10-19 US disclosed
CN-107207472-A Inhibitors of AKT kinase 卑尔根生物股份公司 2017-09-26 CN disclosed
US-9701616-B2 Treprostinil derivatives and compositions and uses thereof Corsair Pharma, Inc. (US) 2017-07-11 US disclosed
US-9643911-B2 Treprostinil derivatives and compositions and uses thereof Corsair Pharma, Inc. (US) 2017-05-09 US disclosed
WO-2012117001-A1 NOVEL BENZODIOXOLE PIPERIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-09-07 WO disclosed
US-20120225868-A1 NOVEL BENZODIOXOLE PIPERIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-09-06 US disclosed
WO-2012110470-A1 NOVEL BENZODIOXOLE PIPERAZINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-08-23 WO disclosed
EP-2344482-B1 BENZO[D]ISOXAZOL-3-YL-PIPERAZIN DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE D3 RECEPTORS HOFFMANN LA ROCHE (CH) 2012-08-15 EP disclosed
EP-2283022-B1 FURO [3, 2-B]PYRR0L-3-0NES AS CATHEPSIN S INHIBITORS AMURA THERAPEUTICS LTD (GB) 2012-07-18 EP disclosed
WO-2012004206-A1 ANELLATED PYRIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-01-12 WO disclosed
US-20120010201-A1 NOVEL ANELLATED PYRIDINE COMPOUNDS HOFFMANN-LA ROCHE INC. 2012-01-12 US disclosed
WO-2011161009-A1 ANELLATED PYRIDINE COMPOUNDS AS DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 2011-12-29 WO disclosed
US-20110313151-A1 ANELLATED PYRIDINE COMPOUNDS HOFFMANN-LA ROCHE, INC. 2011-12-22 US disclosed
US-20110009386-A1 FURO[3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS AMURA THERAPEUTICS LIMITED (GB) 2011-01-13 US 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 (9 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-10336702-B2 Pharmaceutically active compounds UGT2B7, CYP3A5, UGT1A1 ANPEP 2000/4885ENPEP 1055/4885SLC6A1 1605/4885
US-20170298001-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF PTGIS, PTGIR, PDE3A ANPEP 427/4885ENPEP 179/4885SLC6A1 1963/4885
US-20120225868-A1 NOVEL BENZODIOXOLE PIPERIDINE COMPOUNDS HTR2A, HTR2C, HTR1D ANPEP 3753/4885ENPEP 4665/4885SLC6A1 891/4885
US-20210070708-A1 Pharmaceutically Active Compounds UGT2B7, CYP3A5, UGT1A1 ANPEP 2013/4885ENPEP 1070/4885SLC6A1 1666/4885
US-10766861-B2 Pharmaceutically active compounds UGT2B7, CYP3A5, UGT1A1 ANPEP 2013/4885ENPEP 1070/4885SLC6A1 1666/4885
US-20110009386-A1 FURO[3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS CTSS, CTSL, CTSK ANPEP 390/4885ENPEP 824/4885SLC6A1 2735/4885
US-20180029985-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS UGT2B7, CYP3A5, UGT1A1 ANPEP 2000/4885ENPEP 1055/4885SLC6A1 1605/4885
US-20120010201-A1 NOVEL ANELLATED PYRIDINE COMPOUNDS ADORA3, ADORA2A, HTR3A ANPEP 2850/4885ENPEP 3708/4885SLC6A1 1958/4885
US-20110313151-A1 ANELLATED PYRIDINE COMPOUNDS ADORA3, ADORA2A, HTR3A ANPEP 2821/4885ENPEP 3842/4885SLC6A1 2004/4885

“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.