SCHEMBL7322279

SCHEMBL7322279

CCOC(=O)CC(c1ccccc1)N1CC(=O)N(C)c2ccc(I)cc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ITGB3 P05106 3/20 0.40
ITGA2B P08514 3/20 0.40
MAPT P10636 6/20 0.38
CASP3 P42574 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MDM2 Q00987 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34

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
SCHEMBL7334373 0.89 MEN1 (0.39) MEN1KMT2AMAPTTP53POLB
SCHEMBL7329828 0.89 KMT2A (0.39) MEN1KMT2AMAPTTP53POLB
SCHEMBL7332715 0.87 KMT2A (0.39) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7319919 0.85 ITGB3 (0.48) MEN1KMT2AITGB3ITGA2BCASP3
SCHEMBL7320773 0.82 ITGB3 (0.47) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7327913 0.81 MEN1 (0.38) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7328698 0.81 ITGB3 (0.49) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7322816 0.81 MEN1 (0.38) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7325762 0.81 ITGB3 (0.44) MEN1KMT2AITGB3ITGA2BMAPT
SCHEMBL7323160 0.79 MDM2 (0.54) TP53MDM2

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