SCHEMBL13796418

SCHEMBL13796418

CCC12CCC3C4CCC(=O)C=C4C[C@H](C)C3C1C1CC1C21CCC(=O)O1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 19/20 0.75
▸ PGR P06401 18/20 0.75
▸ NR3C2 P08235 3/20 0.55

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
SCHEMBL16572811 1.00 AR (0.75) ARPGRNR3C2
SCHEMBL13768715 1.00 AR (0.75) ARPGRNR3C2
SCHEMBL12942947 1.00 AR (0.75) ARPGRNR3C2
SCHEMBL12998931 0.91 PGR (0.61) ARPGRNR3C2
SCHEMBL16572785 0.90 PGR (0.75) ARPGRNR3C2
SCHEMBL13556634 0.90 PGR (0.78) ARPGRNR3C2
SCHEMBL12998925 0.90 PGR (0.75) ARPGRNR3C2
SCHEMBL12943049 0.90 PGR (0.78) ARPGRNR3C2
SCHEMBL12943138 0.88 PGR (0.59) ARPGRNR3C2
SCHEMBL16572798 0.87 AR (0.76) 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
Send feedback