SCHEMBL7326385

SCHEMBL7326385

CCOC(=O)CC(C)N1CC(=O)N(C(C)C)c2ccc(CCCCOc3cccnc3NC(=O)OC(C)(C)C)cc2C1=O

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TP53 P04637 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA6 Q16445 1/20 0.31
PPIA P62937 1/20 0.31
PTGER4 P35408 3/20 0.31
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30
GCK P35557 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
SCHEMBL7325597 0.93 ITGB3 (0.34) MEN1KMT2ATP53GABRA1GABRG2
SCHEMBL7321764 0.92 MEN1 (0.37) MEN1KMT2ATP53PPIA
SCHEMBL7323078 0.91 PPIA (0.33) MEN1KMT2ATP53GABRA1GABRG2
SCHEMBL7331369 0.91 PPIA (0.33) MEN1KMT2ATP53PPIA
SCHEMBL8842887 0.87 ITGB3 (0.35) MEN1KMT2ATP53GABRA1GABRG2
SCHEMBL7325193 0.85 MEN1 (0.37) MEN1KMT2ATP53GABRA1GABRG2
SCHEMBL7331912 0.84 PPIA (0.32) PPIA
SCHEMBL7325984 0.84 MEN1 (0.36) MEN1KMT2ATP53PPIA
SCHEMBL7329983 0.83 TPSAB1 (0.36) MEN1KMT2A
SCHEMBL7326558 0.83 MEN1 (0.36) MEN1KMT2ATP53PPIA

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 7 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
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