SCHEMBL6615020

SCHEMBL6615020

CC1=CN=Cc2ccccc2N1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL5368821 0.76 GAA (0.41) GAAMAPT
SCHEMBL11389449 0.76 GAA (0.38) GAAMAPT
SCHEMBL10964499 0.73 LMNA (0.49) GAAMAPTKDM4ESMN1; SMN2
SCHEMBL9527218 0.72 GAA (0.38) GAAMAPT
SCHEMBL9789197 0.72 GAA (0.38) GAAMAPTNPC1
SCHEMBL28761886 0.72 GAA (0.38) GAAMAPT
SCHEMBL11520476 0.72 GAA (0.38) GAAMAPT
SCHEMBL29254528 0.72 MAPT (0.38) GAAMAPTRAB9ASMN1; SMN2
SCHEMBL29141757 0.71 GAA (0.36) GAAMAPTSMN1; SMN2
SCHEMBL4703515 0.71 MAPT (0.36) GAAMAPTALDH1A1RAB9ASMN1; SMN2

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-106062092-A Antifouling composition 佐敦集团 2016-10-26 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
US-6011029-A BENZODIAZEPINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-01-04 US 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
EP-0066303-A1 2-Azidomethyl-1,4-benzodiazepines, their salts, process for preparing them and pharmaceutical compositions containing them Kali-Chemie Pharma GmbH (DE) 1982-12-08 EP disclosed
EP-0054839-A2 2-Acylaminomethyl-1,4-benzodiazepines and their salts, methods of preparing them and pharmaceutical compositions containing them Kali-Chemie Pharma GmbH (DE) 1982-06-30 EP disclosed