SCHEMBL13797211

SCHEMBL13797211

C=C1CC2C(CCC3(C)C2C2CC2C32CCC(=O)O2)C2CCC(=O)C=C12

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 15/20 0.69
▸ AR P10275 15/20 0.69
▸ LMNA P02545 1/20 0.53
▸ ABCC4 O15439 1/20 0.53
▸ ABCB11 O95342 1/20 0.53
▸ NR3C1 P04150 1/20 0.53
▸ CHRM2 P08172 1/20 0.53
▸ HTR2A P28223 1/20 0.53
▸ HTR2B P41595 1/20 0.53
▸ CYP19A1 P11511 1/20 0.41
▸ NR3C2 P08235 1/20 0.35

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
SCHEMBL12943024 1.00 PGR (0.69) PGRARLMNAABCC4ABCB11
SCHEMBL12998920 0.90 PGR (0.59) PGRARLMNAABCC4ABCB11
SCHEMBL12943020 0.88 PGR (0.56) PGRARLMNAABCC4ABCB11
SCHEMBL12943027 0.86 PGR (0.51) PGRARLMNAABCC4ABCB11
SCHEMBL12942811 0.85 PGR (0.50) PGRARLMNAABCC4ABCB11
SCHEMBL12998942 0.82 PGR (1.00) PGRARLMNAABCC4ABCB11
SCHEMBL16572795 0.82 PGR (1.00) PGRARLMNAABCC4ABCB11
SCHEMBL16572790 0.82 PGR (1.00) PGRARLMNAABCC4ABCB11
SCHEMBL12942951 0.82 PGR (1.00) PGRARLMNAABCC4ABCB11
SCHEMBL12906882 0.81 PGR (0.45) PGRARCYP19A1

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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