SCHEMBL10054935

SCHEMBL10054935

CC[Si](CC)(CC)OC1CCCC2(C)C(=O)CC[C@@H]12

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 20/20 0.44

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
SCHEMBL9975516 1.00 CYP19A1 (0.44) CYP19A1
SCHEMBL9947147 1.00 CYP19A1 (0.44) CYP19A1
SCHEMBL12322074 1.00 CYP19A1 (0.44) CYP19A1
SCHEMBL14284431 1.00 CYP19A1 (0.44) CYP19A1
SCHEMBL13317271 0.81 PPM1D (0.32)
SCHEMBL21613284 0.79 CYP19A1 (0.40) CYP19A1
SCHEMBL20244226 0.79 CYP19A1 (0.40) CYP19A1
SCHEMBL13407042 0.79 CYP19A1 (0.49) CYP19A1
SCHEMBL16070284 0.73 PPM1D (0.34) CYP19A1
SCHEMBL13528662 0.72 LSS (0.31)

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-2001842-B1 2-METHYLENE-1ALPHA-HYDROXY-19,21-DINORVITAMIN D3 ANALOGS AND USES THEREOF WISCONSIN ALUMNI RES FOUND (US) 2012-06-06 EP disclosed