SCHEMBL1225628

SCHEMBL1225628

O=c1[nH]c2c(c(=O)o1)COCC2c1cc(F)cc(F)c1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.35

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
SCHEMBL512468 0.80 CYP19A1 (0.37) CYP19A1
SCHEMBL512655 0.78 CYP19A1 (0.35) CYP19A1
SCHEMBL1226818 0.77 WNT3A (0.36)
SCHEMBL1226835 0.75 WNT3A (0.39)
SCHEMBL512872 0.66 CYP19A1 (0.38) CYP19A1
SCHEMBL511836 0.65 CYP19A1 (0.33) CYP19A1
SCHEMBL512672 0.64 CYP19A1 (0.36) CYP19A1
SCHEMBL512723 0.63 IDO1 (0.39)
SCHEMBL512155 0.63 CYP19A1 (0.42) CYP19A1
SCHEMBL1274359 0.62 CYP19A1 (0.35) CYP19A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2668168-A1 COMPOUNDS FOR THE REDUCTION OF ß-AMYLOID PRODUCTION Bristol-Myers Squibb Company (US) 2013-12-04 EP disclosed
WO-2012103297-A1 COMPOUNDS FOR THE REDUCTION OF β-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2012-08-02 WO disclosed
EP-2459197-A1 COMPOUNDS FOR THE REDUCTION OF -AMYLOID PRODUCTION Bristol-Myers Squibb Company (US) 2012-06-06 EP disclosed
WO-2011014535-A1 COMPOUNDS FOR THE REDUCTION OF β-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2011-02-03 WO disclosed