SCHEMBL7327797

SCHEMBL7327797

CN1C(=O)C(c2ccccc2)N(C(CC(=O)OC(=O)C(F)(F)F)c2ccccc2)C(=O)c2cc(CCCC(N)S)ccc21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.35
NOTCH1 P46531 1/20 0.30
NOTCH2 Q04721 1/20 0.30
NOTCH4 Q99466 1/20 0.30
NOTCH3 Q9UM47 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
SCHEMBL7330745 0.92 MDM2 (0.31) MDM2
SCHEMBL7332127 0.91 MDM2 (0.34) MDM2
SCHEMBL7323194 0.91
SCHEMBL7332536 0.91 MDM2 (0.33) MDM2
SCHEMBL7330896 0.90 MDM2 (0.35) MDM2
SCHEMBL7323773 0.90 MDM2 (0.36) MDM2
SCHEMBL8836995 0.86 MDM2 (0.33) MDM2
SCHEMBL7325547 0.84 MDM2 (0.32) MDM2
SCHEMBL7328889 0.84 SLC6A9 (0.34) MDM2
SCHEMBL7328663 0.83 MDM2 (0.30) MDM2

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
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