SCHEMBL567321

SCHEMBL567321

CCOC(=O)C1(C)CCCNC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.41
OPRM1 P35372 3/20 0.41
SLC6A4 P31645 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
OPRD1 P41143 2/20 0.31
OPRK1 P41145 2/20 0.31
SLC22A1 O15245 1/20 0.31
ADRA1A P35348 1/20 0.31
KCNH2 Q12809 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL5215702 1.00 BRD4 (0.41) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL567320 1.00 BRD4 (0.41) BRD4OPRM1SLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL7093253 0.98 BRD4 (0.40) BRD4OPRM1SLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL30427479 0.98 BRD4 (0.40) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL15760245 0.89 OPRM1 (0.46) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL630094 0.86 OPRM1 (0.48) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL1963692 0.81 BRD4 (0.47) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL2811875 0.81 OPRM1 (0.42) BRD4OPRM1SLC6A4SLC6A2SLC6A3
SCHEMBL17892425 0.80 NPSR1 (0.37) OPRM1SMN1; SMN2MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL25271505 0.80 BRD4 (0.46) BRD4OPRM1SLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3248980-B1 JAK INHIBITOR WUXI FORTUNE PHARMACEUTICAL CO LTD (CN) 2023-09-06 EP disclosed
CN-115536696-B ENPP1 inhibitors 上海齐鲁制药研究中心有限公司 2023-07-14 CN disclosed
US-11091436-B2 Process for the separation of optical isomers of racemic 3-alkylpiperidine-carboxylic acid ethyl esters RICHTER GEDEON NYRT. (HU) 2021-08-17 US disclosed
US-11026946-B2 Pharmacologically active alicyclic-substituted pyrazolo[1,5-a]pyrimidine derivatives RICHTER GEDEON NYRT. (HU) 2021-06-08 US disclosed
CN-108349977-B JAK inhibitors 无锡福祈制药有限公司 2021-05-25 CN disclosed
US-10960007-B2 Pharmacologically active aryl-substituted pyrazolo[1,5-a]pyrimidine derivatives RICHTER GEDEON NYRT. (HU) 2021-03-30 US disclosed
US-20200131126-A1 Process for the Separation of Optical Isomers of Racemic 3-Alkylpiperidine-Carboxylic Acid Ethyl Esters RICHTER GEDEON NYRT. (HU) 2020-04-30 US disclosed
US-20200129515-A1 Pharmacologically Active Alicyclic-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives RICHTER GEDEON NYRT. (HU) 2020-04-30 US disclosed
US-10617690-B2 JAK inhibitor Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2020-04-14 US disclosed
US-20200061068-A1 Pharmacologically Active Aryl-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives RICHTER GEDEON NYRT. (HU) 2020-02-27 US disclosed
WO-2002057250-A1 TETRAHYDROPYRAN DERIVATIVES AS NEUROKININ RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2002-07-25 WO disclosed
US-20020042431-A1 Zwitterionic tachykinin receptor antagonists MERCK & CO., INC. 2002-04-11 US disclosed
WO-2002024629-A1 ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2002-03-28 WO disclosed
EP-1165540-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2002-01-02 EP disclosed
WO-2000056728-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2000-09-28 WO disclosed
WO-2000056727-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2000-09-28 WO disclosed
EP-0635485-B1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEM RES (JP) 1997-06-11 EP disclosed
US-5554581-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
US-5506190-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-04-09 US disclosed
EP-0635485-A1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-01-25 EP 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 (7 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-20020042431-A1 Zwitterionic tachykinin receptor antagonists NPY5R, NPY1R, NPY2R BRD4 3300/4885OPRM1 163/4885SLC6A4 124/4885
US-20200061068-A1 Pharmacologically Active Aryl-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives GABRA5, P2RX5, P2RY1 BRD4 1247/4885OPRM1 153/4885SLC6A4 220/4885
US-10617690-B2 JAK inhibitor JAK2, JAK1, JAK3 BRD4 379/4885OPRM1 4398/4885SLC6A4 2980/4885
US-20200129515-A1 Pharmacologically Active Alicyclic-Substituted Pyrazolo[1,5-a]Pyrimidine Derivatives GABRA5, GABRA1, P2RX5 BRD4 1749/4885OPRM1 248/4885SLC6A4 244/4885
US-10960007-B2 Pharmacologically active aryl-substituted pyrazolo[1,5-a]pyrimidine derivatives GABRA5, P2RX5, P2RY1 BRD4 1247/4885OPRM1 153/4885SLC6A4 220/4885
US-11091436-B2 Process for the separation of optical isomers of racemic 3-alkylpiperidine-carboxylic acid ethyl esters ARHGDIA, ALDH1A2, AKR1C3 BRD4 4859/4885OPRM1 369/4885SLC6A4 3710/4885
US-11026946-B2 Pharmacologically active alicyclic-substituted pyrazolo[1,5-a]pyrimidine derivatives GABRA5, GABRA1, P2RX5 BRD4 1749/4885OPRM1 248/4885SLC6A4 244/4885

“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.