SCHEMBL7993205

SCHEMBL7993205

CN(C(=O)c1cccc(NC[C@@H](N)CS)c1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.55
FNTB P49356 10/20 0.55
PGGT1B P53609 7/20 0.55
KDM1A O60341 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL7993202 1.00 FNTA (0.55) FNTAFNTBPGGT1BKDM1AMAOA
Hydrochloric Acid SCHEMBL8000784 0.99 FNTA (0.54) FNTAFNTBPGGT1BKDM1AMAOA
Hydrochloric Acid SCHEMBL8000780 0.99 FNTA (0.54) FNTAFNTBPGGT1BKDM1AMAOA
SCHEMBL8934738 0.87 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL8934741 0.87 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL7983219 0.81 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL7983222 0.81 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL7994795 0.79 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL7994798 0.79 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL9518079 0.79 AKR1C3 (0.51) KDM1AMAOAMAOB

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 6 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
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