SCHEMBL13770129

SCHEMBL13770129

CCC1C2C=CC3=CC(=O)CCC3C2CCC1(CC)CCCCOC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.46
▸ PGR P06401 4/20 0.46
▸ 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
SCHEMBL13797499 0.87 AR (0.45) ARPGRNR3C2
SCHEMBL13770649 0.87 AR (0.44) ARPGRNR3C2
SCHEMBL13474778 0.82 AR (0.45) ARPGRNR3C2
SCHEMBL13769017 0.78 AR (0.44) ARPGRNR3C2
SCHEMBL13770653 0.77 AR (0.48) ARPGRNR3C2
SCHEMBL13770481 0.77 AR (0.41) ARPGRNR3C2
SCHEMBL13797697 0.75 AR (0.44) ARPGRNR3C2
SCHEMBL14099451 0.75 AR (0.49) ARPGRNR3C2
SCHEMBL13474796 0.71 AR (0.50) ARPGRNR3C2
SCHEMBL13474795 0.71 AR (0.57) 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-2009083268-A2 17-(1'-PROPENYL)-17-3'-OXIDOESTRA-4-EN-3-ONE DERIVATIVE, USE THEREOF, AND MEDICAMENT CONTAINING SAID DERIVATIVE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-07-09 — — WO disclosed
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