SCHEMBL7002866

SCHEMBL7002866

N#CN=C(NCc1ccc2c(c1)OCO2)N1CCN(C2c3ccc(Cl)cc3SCc3cccnc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.61
FNTB P49356 17/20 0.61
HRAS P01112 1/20 0.39
KRAS P01116 1/20 0.39

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
SCHEMBL7002864 1.00 FNTA (0.61) FNTAFNTBHRASKRAS
SCHEMBL7000432 0.89 FNTA (0.47) FNTAFNTB
SCHEMBL7000433 0.89 FNTA (0.47) FNTAFNTB
SCHEMBL6999410 0.88 FNTA (0.75) FNTAFNTBHRASKRAS
SCHEMBL7002868 0.87 FNTA (0.78) FNTAFNTB
SCHEMBL6994980 0.77 FNTA (0.64) FNTAFNTB
SCHEMBL6994976 0.77 FNTA (0.64) FNTAFNTB
SCHEMBL6999405 0.76 FNTA (1.00) FNTAFNTBHRASKRAS
SCHEMBL6999407 0.76 FNTA (1.00) FNTAFNTBHRASKRAS
SCHEMBL7000434 0.76 FNTA (0.61) FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021448-B1 TRICYCLIC COMPOUNDS HAVING ACTIVITY AS Ras-FPT INHIBITORS SCHERING CORP (US) 2003-05-02 EP disclosed
US-6130229-A Tricyclic compounds having activity as RAS-FPT inhibitors SCHERING CORPORATION (US) 2000-10-10 US disclosed