SCHEMBL7681229

SCHEMBL7681229

N#Cc1ccc(Cn2cncc2CCNC(=O)[C@H]2CN(Cc3ccccc3)CCN2C(=O)CC2CCN(C(N)=O)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 0.48
FNTB P49356 20/20 0.48
PGGT1B P53609 17/20 0.48
KCNH2 Q12809 2/20 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
SCHEMBL7679247 0.82 FNTA (0.50) FNTAFNTBPGGT1BKCNH2
SCHEMBL4459587 0.80 FNTA (0.53) FNTAFNTBPGGT1BKCNH2
SCHEMBL8095394 0.80 FNTA (0.60) FNTAFNTBPGGT1BKCNH2
SCHEMBL7673415 0.79 FNTA (0.52) FNTAFNTBPGGT1BKCNH2
SCHEMBL7678087 0.79 FNTA (0.51) FNTAFNTBPGGT1BKCNH2
SCHEMBL7682600 0.79 FNTA (0.53) FNTAFNTBPGGT1BKCNH2
SCHEMBL8441677 0.76 FNTA (0.55) FNTAFNTBPGGT1BKCNH2
SCHEMBL8103727 0.76 FNTA (0.55) FNTAFNTBPGGT1BKCNH2
SCHEMBL8088609 0.75 FNTA (0.61) FNTAFNTBPGGT1BKCNH2
SCHEMBL8095374 0.75 FNTA (0.61) FNTAFNTBPGGT1BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432959-B1 ANTITUMOR AGENTS SCHERING CORPORATION 2002-08-13 US disclosed
EP-1140909-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2001-10-10 EP disclosed
WO-2000039119-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2000-07-06 WO disclosed