SCHEMBL14129705

SCHEMBL14129705

Cc1ccc(C#Cc2cccc(Oc3ccc(C(=O)c4ccc(Oc5cccc(C#Cc6ccccc6)c5)cc4)cc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 5/20 0.51
FFAR1 O14842 3/20 0.50
POLB P06746 1/20 0.48
VCP P55072 1/20 0.48
ALOX5 P09917 2/20 0.47
MAPK14 Q16539 1/20 0.46
HAO1 Q9UJM8 2/20 0.46
FFAR4 Q5NUL3 1/20 0.44
AKR1C3 P42330 1/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL6369244 0.99 SRD5A2 (0.53) SRD5A2FFAR1POLBVCPALOX5
SCHEMBL13059383 0.92 SRD5A2 (0.57) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL9945719 0.91 FFAR1 (0.52) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL14096283 0.91 FFAR1 (0.54) SRD5A2FFAR1POLBAKR1C3LMNA
SCHEMBL6368706 0.90 SRD5A2 (0.58) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL6368727 0.88 MMP13 (0.52) FFAR1HAO1
SCHEMBL9945718 0.88 SRD5A2 (0.53) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL14129699 0.87 SRD5A2 (0.51) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL9945720 0.87 PGR (0.54) SRD5A2FFAR1POLBALOX5HAO1
SCHEMBL12228178 0.86 FFAR1 (0.50) SRD5A2FFAR1POLBAKR1C3LMNA

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
US-20080159114-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE GLOBALFOUNDRIES INC. (KY) 2008-07-03 US disclosed