SCHEMBL8106910

SCHEMBL8106910

COC(=O)[C@H](CCSC)NC(=O)c1ccc(N)cc1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.74
TAS1R3 Q7RTX0 2/20 0.65
TAS1R1 Q7RTX1 2/20 0.65
GAA P10253 1/20 0.57
CA2 P00918 2/20 0.55
CA1 P00915 1/20 0.55
KMT2A Q03164 1/20 0.54
PPID Q08752 1/20 0.54
FNTA P49354 3/20 0.53
FNTB P49356 3/20 0.53
MAPK14 Q16539 1/20 0.51
HTT P42858 1/20 0.50
CASP1 P29466 1/20 0.49
USP2 O75604 1/20 0.49
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 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
SCHEMBL8367884 1.00 L3MBTL1 (0.74) L3MBTL1TAS1R3TAS1R1GAACA2
Hydrochloric Acid SCHEMBL8362566 0.99 L3MBTL1 (0.73) L3MBTL1TAS1R3TAS1R1GAACA2
Cysteine SCHEMBL8362760 0.89 L3MBTL1 (0.60) L3MBTL1TAS1R3TAS1R1GAACA2
SCHEMBL26814873 0.88 L3MBTL1 (0.73) L3MBTL1TAS1R3TAS1R1GAACA2
SCHEMBL9087989 0.87 L3MBTL1 (0.58) L3MBTL1TAS1R3TAS1R1GAACA2
SCHEMBL9087997 0.87 L3MBTL1 (0.58) L3MBTL1TAS1R3TAS1R1GAACA2
SCHEMBL9830498 0.86 CA2 (0.72) L3MBTL1CA2CA1KMT2AFNTA
SCHEMBL2323686 0.86 L3MBTL1 (0.74) L3MBTL1TAS1R3TAS1R1GAACA2
SCHEMBL9432949 0.86 CA2 (0.72) L3MBTL1CA2CA1KMT2AFNTA
SCHEMBL18095164 0.86 L3MBTL1 (0.74) L3MBTL1TAS1R3TAS1R1GAACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6011175-A Inhibition of farnesyltransferase UNIVERSITY OF PITTSBURGH (US) 2000-01-04 US disclosed
US-5965539-A PEPTIDOMIMETICS; ANTI-CANCER DRUGS UNIVERISTY OF PITTSBURGH (US) 1999-10-12 US disclosed
EP-0794789-A4 INHIBITORS OF PRENYL TRANSFERASES UNIV PITTSBURGH (US) 1999-05-26 EP disclosed
EP-0817630-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-01-27 EP disclosed
EP-0817630-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-01-14 EP disclosed
US-5705686-A 3-MERCAPTO-2-AMINO-PROPYLAMINOBIPHENYL DERIVATIVES; PEPTIDOMIMETICS; ANTICARCINOGENIC AGENTS UNIVERSITY OF PITTSBURGH (US) 1998-01-06 US disclosed
EP-0794789-A1 INHIBITORS OF PRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1997-09-17 EP disclosed
US-5578629-A ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-11-26 US disclosed
WO-1996030015-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed
WO-1996021456-A1 INHIBITORS OF PRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1996-07-18 WO disclosed
US-5534537-A Prodrugs of inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1996-07-09 US disclosed