SCHEMBL7994759

SCHEMBL7994759

Cc1cccc(NC(=O)c2cccc(CNC[C@@H](N)CS)c2)c1C

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.56
FNTB P49356 4/20 0.56
PGGT1B P53609 3/20 0.56
ATM Q13315 1/20 0.46
MAPT P10636 5/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HTT P42858 2/20 0.45
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.42
ANPEP P15144 1/20 0.42
ENPEP Q07075 1/20 0.42
ITGA4 P13612 1/20 0.41
ITGB7 P26010 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7996862 1.00 FNTA (0.56) FNTAFNTBPGGT1BATMMAPT
Hydrochloric Acid SCHEMBL8000351 0.99 FNTA (0.55) FNTAFNTBPGGT1BATMMAPT
Hydrochloric Acid SCHEMBL7994749 0.99 FNTA (0.55) FNTAFNTBPGGT1BATMMAPT
SCHEMBL8934700 0.91 FNTA (0.48) FNTAFNTBPGGT1BATMMAPT
SCHEMBL8934701 0.86 FNTA (0.44) FNTAFNTBPGGT1BATMMAPT
SCHEMBL8934699 0.86 FNTA (0.44) FNTAFNTBPGGT1BATMMAPT
SCHEMBL7995119 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTSMN1; SMN2
SCHEMBL7993171 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTSMN1; SMN2
SCHEMBL7993175 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTSMN1; SMN2
SCHEMBL8934745 0.83 HTT (0.48) FNTAFNTBPGGT1BHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0817629-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2000-03-08 EP claimed
EP-0817629-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-14 EP claimed
WO-1996030014-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO claimed
EP-0817629-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2000-03-08 EP disclosed
EP-0817629-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-14 EP disclosed
US-5631280-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1997-05-20 US disclosed
WO-1996030014-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed