SCHEMBL7327994

SCHEMBL7327994

CCOC(=O)CC(c1ccccc1)N1C(=O)c2cc(CCC(=O)NCC(N)C(=O)OC(C)(C)C)ccc2N(c2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.31
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
SCHEMBL7333356 0.92 NR1H2 (0.33) NR1H2
SCHEMBL7326332 0.92 ITGB3 (0.34) NR1H2F2F10ITGB3ITGA2B
SCHEMBL7331853 0.91 NR1H2 (0.32) NR1H2F2F10ITGB3ITGA2B
SCHEMBL7324131 0.90 HDAC3 (0.34) NR1H2F2F10ITGB3ITGA2B
SCHEMBL9493769 0.90 PDCD1 (0.37)
SCHEMBL7323596 0.85 MDM2 (0.31)
SCHEMBL7326616 0.85 MEN1 (0.33) NR1H2
SCHEMBL7331594 0.84 NR1H2 (0.34) NR1H2F2F10ITGB3ITGA2B
SCHEMBL7324643 0.84 PDCD1 (0.36)
SCHEMBL7324454 0.84 NR1H2 (0.33) NR1H2

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-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
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed