SCHEMBL7334108

SCHEMBL7334108

Nc1ncccc1OCCCCc1ccc2c(c1)C(=O)N(C(CC(=O)OC(=O)C(F)(F)F)c1ccccc1)CC(=O)N2c1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL7327346 0.92 ITGB3 (0.32)
SCHEMBL7332680 0.91 ITGB3 (0.34) MEN1KMT2ATP53
Trifluoroacetic Acid SCHEMBL7334105 0.91 MEN1 (0.36) MEN1KMT2ATP53
SCHEMBL7331919 0.90 PTGDR2 (0.31) MEN1KMT2ATP53
SCHEMBL7319156 0.90 MEN1 (0.33) MEN1KMT2ATP53
SCHEMBL7330877 0.87 ITGB3 (0.32) MEN1KMT2ATP53
SCHEMBL7326326 0.87 MEN1 (0.33) MEN1KMT2A
SCHEMBL7325995 0.85
Trifluoroacetic Acid SCHEMBL7327342 0.85 ITGB3 (0.37)
SCHEMBL8842584 0.84 MEN1 (0.33) MEN1KMT2A

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
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-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