SCHEMBL7543866

SCHEMBL7543866

CC1(C)C=CCC(c2ccc(F)cc2)=C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
PTGS1 P23219 3/20 0.33
PTGS2 P35354 3/20 0.33
MAPK14 Q16539 1/20 0.31

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
SCHEMBL7559598 0.81 PGR (0.30)
SCHEMBL7624027 0.81 SIGMAR1 (0.34) PTGS1PTGS2
SCHEMBL7562811 0.81 PGR (0.36) PTGS1PTGS2
SCHEMBL7568643 0.66 PGR (0.35)
SCHEMBL13221422 0.65 MAPK14 (0.41) PTGS1PTGS2MAPK14
SCHEMBL7691782 0.64 CYP2A6 (0.35)
SCHEMBL6816479 0.63 PCSK9 (0.34)
SCHEMBL9754961 0.63 PTGS1 (0.39) LPLLIPGPTGS1PTGS2MAPK14
SCHEMBL10468456 0.62 PTGS1 (0.35) LPLLIPGPTGS1PTGS2MAPK14
SCHEMBL11611011 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002543193-A 2002-12-17 JP claimed
EP-1173426-A1 CYCLOCARBAMATE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS American Home Products Corporation (US) 2002-01-23 EP claimed
WO-2000066571-A1 CYCLOCARBAMATE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-11-09 WO claimed
CN-1131856-C Cyclothiocarbamate derivatives as progesterone receptor modulators AMERICAN HOME PRODUCTS CORP. (US) 2003-12-24 CN disclosed
CN-1349516-A Cyclothiocarbamate derivatives as progesterone receptor modulators AMERICAN HOME PROD (US) 2002-05-15 CN disclosed