SCHEMBL7586274

SCHEMBL7586274

CCC1(c2cccc(OC)c2)CCCCN(C)C1=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.52
FNTB P49356 14/20 0.52
PGGT1B P53609 14/20 0.52
SIGMAR1 Q99720 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL7564884 1.00 FNTA (0.52) FNTAFNTBPGGT1BSIGMAR1SLC6A2
SCHEMBL7571079 1.00 FNTA (0.52) FNTAFNTBPGGT1BSIGMAR1SLC6A2
Cyclopropane SCHEMBL7680538 0.99 FNTA (0.51) FNTAFNTBPGGT1BSIGMAR1KMT2A
SCHEMBL7678882 0.91 FNTA (0.51) FNTAFNTBPGGT1BSIGMAR1
SCHEMBL7677003 0.89 FNTA (0.43) FNTAFNTBPGGT1BSIGMAR1SLC6A2
SCHEMBL7677725 0.89 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL7680592 0.87 FNTA (0.44) FNTAFNTBPGGT1BSIGMAR1SLC6A2
SCHEMBL7678961 0.86 FNTA (0.53) FNTAFNTBPGGT1BSIGMAR1SLC6A2
SCHEMBL7677229 0.85 FNTA (0.43) FNTAFNTBPGGT1BSIGMAR1SLC6A2
SCHEMBL8195311 0.85 FNTA (0.41) FNTAFNTBPGGT1BSIGMAR1KMT2A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002079147-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2002-10-10 WO disclosed
US-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease MERCK & CO., INC. 2002-03-28 US disclosed
US-6284755-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-09-04 US disclosed
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO disclosed
EP-0021772-B1 METHOD OF PREPARING 2-OXO- AND 2-UNSUBSTITUTED-HEXAHYDROAZEPINE DERIVATIVES JOHN WYETH & BROTHER LIMITED (GB) 1985-01-02 EP disclosed
EP-0003253-B1 HEXAHYDROAZEPINE, PIPERIDINE AND PYRROLIDINE DERIVATIVES AND PROCESSES FOR MAKING AND USING THEM JOHN WYETH & BROTHER LIMITED (GB) 1982-12-22 EP disclosed
US-4296029-A Process for preparing hexahydroazepine, piperidine and pyrrolidine derivatives JOHN WYETH & BROTHER LIMITED (GB) 1981-10-20 US disclosed
EP-0021772-A1 Method of preparing 2-oxo- and 2-unsubstituted-hexahydroazepine derivatives JOHN WYETH & BROTHER LIMITED (GB) 1981-01-07 EP disclosed
US-4197241-A Hexahydroazepine, piperidine and pyrrolidine derivatives JOHN WYETH & BROTHER LIMITED (GB) 1980-04-08 US disclosed
EP-0003253-A1 Hexahydroazepine, piperidine and pyrrolidine derivatives and processes for making and using them JOHN WYETH & BROTHER LIMITED (GB) 1979-08-08 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 (1 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-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease FNTA, PKD1, FNTB FNTA 1/4885FNTB 3/4885PGGT1B 256/4885

“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.