SCHEMBL6616154

SCHEMBL6616154

COC(=O)[C@@H](Cc1ccccc1)N(Cc1cc(Br)ccc1N)S(C)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EPOR P19235 1/20 0.37
ANPEP P15144 1/20 0.37

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
SCHEMBL6615305 1.00 MEN1 (0.47) MEN1KMT2APOLBNPSR1KDM4E
SCHEMBL6615309 1.00 MEN1 (0.47) MEN1KMT2APOLBNPSR1KDM4E
SCHEMBL6614754 0.88 KMT2A (0.44) MEN1KMT2APOLBCA12CA2
SCHEMBL6614758 0.88 KMT2A (0.44) MEN1KMT2APOLBCA12CA2
SCHEMBL6628304 0.88 KMT2A (0.44) MEN1KMT2APOLBCA12CA2
SCHEMBL6613804 0.76 MMP1 (0.49)
SCHEMBL6613799 0.76 MMP1 (0.49)
SCHEMBL13167494 0.69 PTGES (0.52) MEN1KMT2AEPOR
SCHEMBL8269597 0.69 PTGES (0.52) MEN1KMT2AEPOR
SCHEMBL6628391 0.69 CA12 (0.34) MEN1KMT2APOLBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100376569-C Farnesyl protein transfer inhibitors BRISTOL MYERS SQUIBB CO (US) 2008-03-26 CN disclosed
EP-1481975-A1 Inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-01 EP disclosed
EP-0892797-A4 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2004-10-20 EP disclosed
US-6455523-B1 ADMINISTERING 1,4-BENZODIAZEPINE DERIVATIVE AS ANTITUMOR OR ANTICARCINOGENIC AGENT BRISTOL-MYERS SQUIBB COMPANY 2002-09-24 US disclosed
CN-1347881-A Farnesyl protein transferase inhibitor BRISTOL MYERS SQUIBB CO (US) 2002-05-08 CN disclosed
US-6011029-A BENZODIAZEPINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-01-04 US disclosed
CN-1214685-A Farnesyl protein transfer inhibitors BRISTOL MYERS SQUIBB CO (US) 1999-04-21 CN disclosed
EP-0892797-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-01-27 EP disclosed
WO-1997030992-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1997-08-28 WO disclosed