SCHEMBL11482170

SCHEMBL11482170

CC(=O)CC(C)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 4/20 0.54
ACACA Q13085 3/20 0.54
FFAR1 O14842 3/20 0.52
SRD5A2 P31213 1/20 0.49
LTB4R Q15722 1/20 0.48
LTB4R2 Q9NPC1 1/20 0.48
PTGS1 P23219 1/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
LTA4H P09960 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45

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
SCHEMBL13140159 0.88 FFAR1 (0.64) ACACBACACAFFAR1SRD5A2LTB4R
SCHEMBL11138445 0.86 PTGS1 (0.63) ACACBACACAFFAR1PTGS1
SCHEMBL1149358 0.84 FFAR1 (0.53) FFAR1
SCHEMBL11484603 0.84 FFAR1 (0.53) FFAR1
SCHEMBL1149769 0.84 FFAR1 (0.53) FFAR1
SCHEMBL20573131 0.83 NPC1 (0.52) ACACBACACAFFAR1SRD5A2LTB4R
SCHEMBL28726111 0.82 ACACB (0.53) ACACBACACAFFAR1SRD5A2LTB4R
SCHEMBL11134856 0.81 PTGS2 (0.56) FFAR1
SCHEMBL13140340 0.81 FFAR1 (0.56) ACACBACACAFFAR1FNTAFNTB
SCHEMBL29110949 0.81 L3MBTL1 (0.50) ACACBACACAFFAR1SRD5A2PDE4A

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-4216232-A Pharmaceutical compositions BEECHAM GROUP LIMITED (GB) 1980-08-05 US claimed