SCHEMBL13797041

SCHEMBL13797041

C=CCC12CCC3C4CCC(=O)C=C4C=CC3C1C1CC1C21C=CC(=O)O1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 20/20 0.54
▸ PGR P06401 19/20 0.54
▸ NR3C2 P08235 2/20 0.46

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
SCHEMBL12906958 0.88 AR (0.67) ARPGRNR3C2
SCHEMBL13556652 0.88 AR (0.57) ARPGRNR3C2
SCHEMBL12906924 0.88 AR (0.67) ARPGRNR3C2
SCHEMBL13557231 0.88 AR (0.54) ARPGRNR3C2
SCHEMBL13768837 0.83 AR (0.49) ARPGRNR3C2
SCHEMBL13556654 0.82 PGR (0.53) ARPGRNR3C2
SCHEMBL12906893 0.82 AR (0.65) ARPGRNR3C2
SCHEMBL12906979 0.82 AR (0.65) ARPGRNR3C2
SCHEMBL12907014 0.82 AR (0.65) ARPGRNR3C2
SCHEMBL13556655 0.78 AR (0.42) ARPGRNR3C2

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
WO-2009083269-A1 15,16-METHYLENE-17-HYDROXY-19-NOR-21-CARBOXYLIC ACID γ-LACTONE DERIVATIVE, USE THEREOF, AND MEDICAMENT CONTAINING SAID DERIVATIVE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-07-09 — — WO disclosed
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