SCHEMBL7320615

SCHEMBL7320615

CCOC(=O)CC(c1ccccc1)N1C(=O)c2cc(CCCCOc3cccnc3NC(=O)OC(C)(C)C)ccc2N(Cc2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 2/20 0.33
PPIA P62937 3/20 0.32
NPY1R P25929 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
SCHEMBL7334581 0.93 MDM2 (0.33) MDM2PPIANPY1R
SCHEMBL7324561 0.92 SCN9A (0.32) MDM2PPIA
SCHEMBL7324067 0.92 PPIA (0.31) PPIA
SCHEMBL7335488 0.91
SCHEMBL8843216 0.91 MDM2 (0.34) MDM2NPY1R
SCHEMBL7327303 0.89 RIPK1 (0.34) MDM2PPIA
SCHEMBL8842961 0.86 MDM2 (0.33) MDM2PPIANPY1R
SCHEMBL7326558 0.86 MEN1 (0.36) PPIA
SCHEMBL7334878 0.85 TPSAB1 (0.35) MDM2
SCHEMBL7331912 0.85 PPIA (0.32) PPIA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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