SCHEMBL6633642

SCHEMBL6633642

N#Cc1ccc2c(c1)CN(C(=O)Oc1ccc([N+](=O)[O-])cc1)C(Cc1ccccc1)CN2

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.44
FNTB P49356 3/20 0.44
MGLL Q99685 3/20 0.42
FAAH O00519 1/20 0.42
KCNJ1 P48048 1/20 0.38
KCNH2 Q12809 1/20 0.38
DRD4 P21917 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
SCHEMBL6615155 1.00 FNTA (0.44) FNTAFNTBMGLLFAAHKCNJ1
SCHEMBL6619143 0.81 FNTA (0.49) FNTAFNTBMGLL
SCHEMBL6634181 0.81 FNTA (0.49) FNTAFNTBMGLL
SCHEMBL7688068 0.79 FNTA (0.47) FNTAFNTBMGLL
SCHEMBL6617793 0.79 FNTA (0.47) FNTAFNTBMGLL
SCHEMBL6637279 0.79 FNTA (0.47) FNTAFNTBMGLL
SCHEMBL7679452 0.79 FNTA (0.47) FNTAFNTBMGLL
SCHEMBL5788241 0.77 FNTA (0.47) FNTAFNTBMGLLDRD4
SCHEMBL5788247 0.77 FNTA (0.47) FNTAFNTBMGLLDRD4
SCHEMBL6633950 0.76 FNTA (0.44) FNTAFNTBMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481975-A1 Inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-01 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