SCHEMBL7320340

SCHEMBL7320340

CC(C)N1C(=O)CN(C(CC(=O)OC(=O)C(F)(F)F)c2ccccc2)C(=O)c2cc(CCCCCN)ccc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RXRA P19793 2/20 0.32
ITGB3 P05106 4/20 0.31
ITGA2B P08514 4/20 0.31
MAPT P10636 1/20 0.31
SSTR1 P30872 4/20 0.31
SSTR2 P30874 4/20 0.31
SSTR4 P31391 4/20 0.31
SSTR5 P35346 4/20 0.31
SSTR3 P32745 3/20 0.31
DPP4 P27487 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL7331386 0.91 ITGB3 (0.37) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL9009310 0.91 ITGB3 (0.37) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7326445 0.90 ITGB3 (0.35) RXRAITGB3ITGA2BDPP4
SCHEMBL7330277 0.90 MEN1 (0.34) MEN1KMT2ARXRAITGB3ITGA2B
SCHEMBL7331609 0.90 ITGB3 (0.33) MEN1KMT2ARXRAITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7320336 0.89 MEN1 (0.42) MEN1KMT2ARXRAITGB3ITGA2B
SCHEMBL7326326 0.89 MEN1 (0.33) MEN1KMT2AITGB3ITGA2BSSTR1
SCHEMBL7332009 0.88 MEN1 (0.33) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7319156 0.87 MEN1 (0.33) MEN1KMT2ARXRATP53
SCHEMBL7331412 0.86 ITGB3 (0.32) MEN1KMT2AITGB3ITGA2B

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 7 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
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed