SCHEMBL14355646

SCHEMBL14355646

COC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)C(F)=C[C@]4(C)C3CC[C@]12C

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.56
SRD5A2 P31213 1/20 0.47

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
SCHEMBL3507240 1.00 AR (0.56) ARSRD5A2
SCHEMBL14533211 1.00 AR (0.56) ARSRD5A2
SCHEMBL3507238 1.00 AR (0.56) ARSRD5A2
SCHEMBL13403477 1.00 AR (0.56) ARSRD5A2
SCHEMBL3505120 0.89 AR (0.57) AR
SCHEMBL14355647 0.89 AR (0.57) AR
SCHEMBL13403481 0.89 AR (0.57) AR
SCHEMBL3505115 0.89 AR (0.57) AR
SCHEMBL4187572 0.84 AR (0.51) AR
SCHEMBL4187575 0.84 AR (0.51) AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7301026-B2 Process for making fluorinated 4-azasteroid derivatives MERCK & CO., INC (US) 2007-11-27 US disclosed
US-7301026-B2 Process for making fluorinated 4-azasteroid derivatives MERCK & CO., INC (US) 2007-11-27 US disclosed