SCHEMBL7330762

SCHEMBL7330762

O=c1oc(=O)n(Cc2ccc3ccccc3c2)c2cc3ccccc3cc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.45
VDR P11473 1/20 0.44
DAO P14920 1/20 0.44
IDO1 P14902 2/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
POLB P06746 2/20 0.42
MIF P14174 4/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.41
NQO1 P15559 1/20 0.40
CD74 P04233 2/20 0.40
HTR3A P46098 1/20 0.40
NPC1 O15118 1/20 0.40
PGR P06401 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7324840 0.89 MIF (0.55) IDO1POLBMIFALDH1A1CD74
SCHEMBL1522234 0.78 MCL1 (0.44) FAAHVDRALDH1A1GAANQO1
SCHEMBL7330501 0.76 CD74 (0.44) IDO1POLBMIFALDH1A1GAA
SCHEMBL7329420 0.71 ELANE (0.46) DAOALDH1A1GAANPC1KMT2A
SCHEMBL28758680 0.71 CYP19A1 (0.60) VDRHTR3AKMT2A
SCHEMBL3921896 0.70 KMT2A (0.54) IDO1POLBMIFCD74KMT2A
SCHEMBL26124443 0.70 IDO1 (0.57) IDO1MIFCD74NPC1
SCHEMBL5535346 0.70 IDO1 (0.54) IDO1POLBMIFCD74NPC1
SCHEMBL28403947 0.70 KMT2A (0.68) VDRDAOALDH1A1GAAHTR3A
SCHEMBL1522607 0.70 MIF (0.66) IDO1POLBMIFALDH1A1CD74

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
US-5674863-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5674865-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 US disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed