SCHEMBL12352182

SCHEMBL12352182

Cc1cc(CCC(=O)OCO)cc(C)c1O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
ALOX5 P09917 2/20 0.43
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
ALDH1A1 P00352 1/20 0.42
APP P05067 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
S1PR1 P21453 1/20 0.39
HMGB1 P09429 1/20 0.39
CXCL12 P48061 1/20 0.39
CYP4Z1 Q86W10 1/20 0.38
ESR1 P03372 2/20 0.38
SHBG P04278 1/20 0.37

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
SCHEMBL15080678 0.89 CYP4F2 (0.46) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL6071507 0.89 ALOX5 (0.52) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL889921 0.88 CYP4F2 (0.57) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL12415241 0.88 CYP4F2 (0.49) CYP4F2CYP4A11ALOX5ALDH1A1APP
SCHEMBL13121602 0.87 CYP4F2 (0.49) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL12919720 0.86 CYP4F2 (0.44) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL19047012 0.86 ALOX5 (0.57) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL17264213 0.85 ALOX5 (0.49) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL12386503 0.85 ALOX5 (0.49) CYP4F2CYP4A11ALOX5PTGS1PTGS2
SCHEMBL2045372 0.85 ALOX5 (0.49) CYP4F2CYP4A11ALOX5PTGS1PTGS2

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-20110186791-A1 ULTRAVIOLET ABSORBENT COMPOSITION FUJIFILM CORPORATION (JP) 2011-08-04 US disclosed