SCHEMBL8959416

SCHEMBL8959416

CC(CC(=O)OC(=O)C(F)(F)F)N1C(=O)c2cc(CCCCOc3cccnc3N)ccc2N(C)C(=O)C1c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL7321439 0.93
SCHEMBL7333627 0.92
SCHEMBL7325547 0.92 MDM2 (0.32) MDM2
Trifluoroacetic Acid SCHEMBL8843044 0.91 MDM2 (0.33) MDM2TAAR1
SCHEMBL7326153 0.88 RIPK1 (0.35) MDM2
SCHEMBL7325218 0.87 MDM2 (0.35) MDM2
SCHEMBL7321520 0.86
Trifluoroacetic Acid SCHEMBL7325538 0.85 MDM2 (0.33) MDM2TAAR1
SCHEMBL7331753 0.84 MDM2 (0.31) MDM2
SCHEMBL7332127 0.84 MDM2 (0.34) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed