SCHEMBL7994795

SCHEMBL7994795

NC(CS)CNc1cccc(C(=O)Nc2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.58
FNTB P49356 7/20 0.58
PGGT1B P53609 4/20 0.58
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
KCNK3 O14649 1/20 0.49
KCNK9 Q9NPC2 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.48
SIRT1 Q96EB6 1/20 0.48

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
SCHEMBL7994798 1.00 FNTA (0.58) FNTAFNTBPGGT1BPOLBKMT2A
Hydrochloric Acid SCHEMBL7996273 0.99 FNTA (0.57) FNTAFNTBPGGT1BPOLBKMT2A
Hydrochloric Acid SCHEMBL7996274 0.99 FNTA (0.57) FNTAFNTBPGGT1BPOLBKMT2A
SCHEMBL7983222 0.86 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL7983219 0.86 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL8934740 0.85 MAPT (0.50) FNTAFNTBPGGT1BKMT2A
SCHEMBL8934736 0.85 MAPT (0.50) FNTAFNTBPGGT1BKMT2A
SCHEMBL7996402 0.85 SIRT2 (0.54) FNTAFNTBPGGT1BHDAC2HDAC8
SCHEMBL7996400 0.85 SIRT2 (0.54) FNTAFNTBPGGT1BHDAC2HDAC8
Hydrochloric Acid SCHEMBL7996930 0.84 SIRT2 (0.53) FNTAFNTBPGGT1BHDAC2HDAC8

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