SCHEMBL7328680

SCHEMBL7328680

CCOC(=O)CC(c1ccccc1)N1C(=O)c2cc(CCCCCC#N)ccc2N(C)C(=O)C1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 10/20 0.36
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
F2 P00734 2/20 0.35
F10 P00742 2/20 0.35
GABRA1 P14867 1/20 0.31
GABRA5 P31644 1/20 0.31
TP53 P04637 2/20 0.30
PTGS1 P23219 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
SCHEMBL7326117 0.91 MAPT (0.31) ITGB3ITGA2BF2F10
SCHEMBL7331017 0.91 KDM4E (0.31) MDM2ITGB3ITGA2BF2F10
SCHEMBL7330344 0.91 MDM2 (0.36) MDM2ITGB3ITGA2BF2F10
SCHEMBL7331638 0.87 MDM2 (0.36) MDM2ITGB3ITGA2BF2F10
SCHEMBL7332372 0.86 HDAC1 (0.39) MDM2ITGB3ITGA2BF2F10
SCHEMBL7318601 0.85 TPSAB1 (0.36) MDM2ITGB3ITGA2BF2F10
SCHEMBL7354809 0.84 ITGB3 (0.34) MDM2ITGB3ITGA2BF2F10
SCHEMBL7324864 0.82 KDM4E (0.32) MDM2TP53
SCHEMBL7323160 0.82 MDM2 (0.54) MDM2TP53
SCHEMBL7327913 0.82 MEN1 (0.38) ITGB3ITGA2BF2F10GABRA1

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-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