SCHEMBL7829812

SCHEMBL7829812

Cc1ncc(CN2CCC(CO)(Cc3cccc(Cl)c3Cl)CC2)n1Cc1ccc(C#N)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.52
FNTB P49356 5/20 0.52
PGGT1B P53609 5/20 0.52
POLB P06746 5/20 0.43
GAA P10253 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
MAPT P10636 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7839733 0.88 FNTA (0.55) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7839572 0.87 FNTA (0.55) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7847643 0.86 FNTA (0.48) FNTAFNTBPGGT1BPOLBMAPT
SCHEMBL7838097 0.86 FNTA (0.55) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7856913 0.86 FNTA (0.61) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL446699 0.85 FNTA (0.53) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7839865 0.84 FNTA (0.53) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7849238 0.84 FNTA (0.49) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7839728 0.84 FNTA (0.51) FNTAFNTBPGGT1BPOLBGAA
SCHEMBL7839131 0.83 FNTA (0.51) FNTAFNTBPGGT1BPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed