SCHEMBL7356241

SCHEMBL7356241

CCOC(=O)CC(c1ccccc1)N1C(=O)c2cc(CCc3cc(C#N)cs3)ccc2N(C(C)C)C(=O)C1c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.32
TP53 P04637 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
F2 P00734 1/20 0.30
F10 P00742 1/20 0.30
ITGB3 P05106 1/20 0.30
ITGA2B P08514 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
SCHEMBL7355407 0.92 MDM2 (0.33) MDM2TP53KDM4EALDH1A1
SCHEMBL7354809 0.92 ITGB3 (0.34) MDM2TP53F2F10ITGB3
SCHEMBL7356935 0.91 ELANE (0.31) F2F10ITGB3ITGA2B
SCHEMBL7357418 0.90 MAPT (0.35) MDM2TP53ALDH1A1F2F10
SCHEMBL7318695 0.90 TNF (0.36) MDM2TP53KDM4EALDH1A1F10
SCHEMBL7357388 0.85 MDM2 (0.33) MDM2TP53KDM4EALDH1A1F2
SCHEMBL7331017 0.85 KDM4E (0.31) MDM2TP53KDM4EALDH1A1F2
SCHEMBL7357194 0.84 MEN1 (0.34)
SCHEMBL7354728 0.84 ELANE (0.33) MDM2TP53
SCHEMBL7362794 0.83 MAPT (0.36) 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