SCHEMBL14470547

SCHEMBL14470547

CC(=O)O[C@H]1C=C(CC(=O)N=O)C(=O)C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.33

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
SCHEMBL14441019 0.80 CYP19A1 (0.36) CYP19A1
SCHEMBL1136293 0.78 SMN1; SMN2 (0.35) CYP19A1
SCHEMBL1136296 0.78 SMN1; SMN2 (0.35) CYP19A1
SCHEMBL9327169 0.75 CYP19A1 (0.34) CYP19A1
SCHEMBL9327170 0.75 CYP19A1 (0.34) CYP19A1
SCHEMBL1136248 0.74 CYP19A1 (0.40) CYP19A1
SCHEMBL1136249 0.72 ALDH1A1 (0.49)
SCHEMBL10704819 0.71 CYP19A1 (0.39) CYP19A1
SCHEMBL23873765 0.70 MAPT (0.41) CYP19A1
SCHEMBL9227084 0.69 NLRP3 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1811037-A1 Process for the preparation of optically active cyclopentenones Chirogate International Inc. (TW) 2007-07-25 EP disclosed