SCHEMBL7356935

SCHEMBL7356935

CCOC(=O)CC(c1ccccc1)N1C(=O)c2cc(CCc3cc(C#N)cs3)ccc2N(c2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.31
MAPT P10636 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
SCHEMBL7354809 0.92 ITGB3 (0.34) F2F10ITGB3ITGA2B
SCHEMBL7354728 0.92 ELANE (0.33) ELANEMAPT
SCHEMBL7356241 0.91 MDM2 (0.32) F2F10ITGB3ITGA2B
SCHEMBL7357418 0.90 MAPT (0.35) MAPTF2F10ITGB3ITGA2B
SCHEMBL7324983 0.90 TNF (0.34) ELANEF10
SCHEMBL7326117 0.85 MAPT (0.31) MAPTF2F10ITGB3ITGA2B
SCHEMBL8842910 0.84 MEN1 (0.34) MAPT
SCHEMBL7357388 0.83 MDM2 (0.33) F2F10ITGB3ITGA2B
SCHEMBL7355407 0.83 MDM2 (0.33)
SCHEMBL7321448 0.82 ELANE (0.38) ELANE

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