SCHEMBL77974

SCHEMBL77974

COc1ccc(CC#N)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.61
ATM Q13315 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 2/20 0.52
PPARG P37231 1/20 0.52
PPARD Q03181 1/20 0.52
PPARA Q07869 1/20 0.52
POLB P06746 1/20 0.50
CYP19A1 P11511 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
BLM P54132 1/20 0.49
PMP22 Q01453 1/20 0.49
AOC3 Q16853 1/20 0.47
LDHA P00338 1/20 0.47
HIF1A Q16665 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL21328364 0.93 CA2 (0.53) CA2ATMKDM4EALDH1A1PPARG
SCHEMBL21328361 0.92 CA2 (0.52) CA2ATMKDM4EALDH1A1PPARG
SCHEMBL21328358 0.92 CA2 (0.52) CA2ATMKDM4EALDH1A1PPARG
Dodecane SCHEMBL11158478 0.90 EPHX2 (0.51) CA2ATMKDM4EPPARGPPARA
SCHEMBL27612963 0.88 ATM (0.75) CA2ATMKDM4EPOLBCYP19A1
SCHEMBL28274696 0.88 SMN1; SMN2 (0.49) CA2ATMKDM4EALDH1A1PPARG
SCHEMBL7315399 0.88 CALM1 (0.56) CA2KDM4EALDH1A1PIK3CDPIK3CA
SCHEMBL7253321 0.88 PDE4A (0.52) CA2KDM4EALDH1A1
SCHEMBL7367373 0.86 CA2 (0.46) CA2ATMKDM4EALDH1A1PPARG
SCHEMBL6361965 0.85 CA2 (0.44) CA2ATMKDM4EALDH1A1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260132108-A1 PREPARATION OF MESEMBRINE KANNA HEALTH LTD (GB) 2026-05-14 US claimed
EP-4614641-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK Innovation Co., Ltd. (KR) 2025-09-10 EP claimed
EP-4611093-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK Innovation Co., Ltd. (KR) 2025-09-03 EP claimed
EP-4611095-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK Innovation Co., Ltd. (KR) 2025-09-03 EP claimed
EP-4611154-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK Innovation Co., Ltd. (KR) 2025-09-03 EP claimed
US-20250273821-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK IE TECHNOLOGY CO., LTD. (KR) 2025-08-28 US claimed
US-20250273741-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK IE TECHNOLOGY CO., LTD. (KR) 2025-08-28 US claimed
US-20250273816-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK INNOVATION CO., LTD. (KR) 2025-08-28 US claimed
US-20250273815-A1 ELECTROCHEMICAL DEVICE INCLUDING POROUS SEPARATOR SK INNOVATION CO., LTD. (KR) 2025-08-28 US claimed
EP-4598904-A1 PREPARATION OF MESEMBRINE Kanna Health Limited (GB) 2025-08-13 EP claimed
US-20020120164-A1 Process for the preparation of 1-[cyano(aryl)methyl] cyclohexanol COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2002-08-29 US claimed
US-5840981-A CATALYTICALLY HYDROGENATING 3,4-DIMETHOXYPHENYLACETONITRILE WITH A METHYLAMINE BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US claimed
CN-1019972-C Process for preparing 5, 6-dihydroxyindoles and 3-alkyl derivatives and intermediate compounds thereof OREAL (FR) 1993-03-03 CN claimed
EP-0211271-B1 PROCESS FOR THE PREPARATION OF VERATRYL CYANIDE BASF Aktiengesellschaft (DE) 1988-10-12 EP claimed
CN-87107372-A Process for preparing 5, 6-dihydroxyindoles and 3-alkyl derivatives and intermediate compounds thereof 1988-08-03 CN claimed
US-4661610-A Preparation of veratryl cyanide BASF AKTIENGESELLSCHAFT (DE) 1987-04-28 US claimed
EP-0211271-A1 Process for the preparation of veratryl cyanide BASF Aktiengesellschaft (DE) 1987-02-25 EP claimed
EP-0142070-B1 PROCESS FOR THE PREPARATION OF N-METHYLHOMOVERATRYL AMINE BASF Aktiengesellschaft (DE) 1986-07-09 EP claimed
EP-0142070-A1 Process for the preparation of N-methylhomoveratryl amine BASF Aktiengesellschaft (DE) 1985-05-22 EP claimed
US-4201632-A Separation of phenol-, cyclohexanone-, and cyclohexylbenzene-containing mixtures employing a nitrile as extraction distillation solvent PHILLIPS PETROLEUM COMPANY (US) 1980-05-06 US 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 (2 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-20260132108-A1 PREPARATION OF MESEMBRINE BHMT, TMSB10, MSMO1 CA2 589/4885ATM 4465/4885KDM4E 561/4885
US-20020120164-A1 Process for the preparation of 1-[cyano(aryl)methyl] cyclohexanol CYP2S1, C1S, CYP1B1 CA2 2452/4885ATM 1878/4885KDM4E 1364/4885

“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.