SCHEMBL7355407

SCHEMBL7355407

CCOC(=O)CC(C)N1C(=O)c2cc(CCc3cc(C#N)cs3)ccc2N(C(C)C)C(=O)C1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7356241 0.92 MDM2 (0.32) MDM2TP53KDM4EALDH1A1
SCHEMBL7357388 0.92 MDM2 (0.33) MDM2TP53KDM4EALDH1A1
SCHEMBL7354728 0.91 ELANE (0.33) MDM2TP53
SCHEMBL7362794 0.90 MAPT (0.36) MDM2TP53ALDH1A1
SCHEMBL7326303 0.89 MDM2 (0.35) MDM2TP53KDM4EALDH1A1
SCHEMBL7354809 0.84 ITGB3 (0.34) MDM2TP53
SCHEMBL7324864 0.84 KDM4E (0.32) MDM2TP53KDM4EALDH1A1
SCHEMBL7356935 0.83 ELANE (0.31)
SCHEMBL7330551 0.82 MDM2 (0.36) MDM2TP53KDM4EALDH1A1
SCHEMBL7357418 0.82 MAPT (0.35) MDM2TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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