SCHEMBL7323996

SCHEMBL7323996

CCOC(=O)CC(C)N1C(=O)c2cc(C#CC(S)CNC(=O)OC(C)(C)C)ccc2N(Cc2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.36
ALDH1A1 P00352 2/20 0.34
SYK P43405 1/20 0.33
MAPT P10636 2/20 0.31
PKM P14618 2/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NPY1R P25929 1/20 0.30
RIPK1 Q13546 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
SCHEMBL7330723 0.93 MDM2 (0.35) MDM2ALDH1A1SYKMAPTPKM
SCHEMBL7328784 0.91 MDM2 (0.34) MDM2SYKRIPK1
SCHEMBL7327814 0.90 MDM2 (0.32) MDM2SYK
SCHEMBL7323458 0.90 GAA (0.32) MDM2SYK
SCHEMBL7323083 0.87 MDM2 (0.38) MDM2ALDH1A1
SCHEMBL7334965 0.85 ITGB3 (0.38) ALDH1A1SYKMAPTPKMMAPK1
SCHEMBL7331722 0.84 UTS2R (0.34) MDM2
SCHEMBL7332703 0.84 MDM2 (0.36) MDM2ALDH1A1MAPTPKMMAPK1
SCHEMBL7326553 0.84 MDM2 (0.33) MDM2SYK
SCHEMBL7325014 0.83 UTS2R (0.32) MDM2

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