SCHEMBL30003253

SCHEMBL30003253

CCCCc1cc(CC(=O)OCC)cc(CCCC)c1O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.45
EGFR P00533 1/20 0.44
CYP4Z1 Q86W10 1/20 0.40
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
GPR84 Q9NQS5 2/20 0.39
ALOX5 P09917 3/20 0.39
ESR1 P03372 1/20 0.39
MAOA P21397 1/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTGS2 P35354 1/20 0.38

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
SCHEMBL7047486 0.86 CYP4F2 (0.50) NR4A1EGFRCYP4Z1PPARAPPARG
SCHEMBL11073015 0.85 CYP4Z1 (0.47) NR4A1EGFRCYP4Z1PPARAPPARG
SCHEMBL8372940 0.80 ALDH1A1 (0.58) EGFRPPARGGPR84ALOX5NPC1
SCHEMBL2804701 0.80 PLA2G4B (0.39) ALOX5ESR1PTGS2
SCHEMBL20979140 0.79 ALOX5 (0.46) EGFRGPR84ALOX5HTTPTGS2
SCHEMBL20381226 0.79 ALOX5 (0.47) PPARAPPARGGPR84ALOX5PTGS2
SCHEMBL18269260 0.78 DGKA (0.47) EGFRCYP4F2CYP4A11ALOX5ESR1
SCHEMBL29151844 0.78 ALOX5 (0.42) EGFRALOX5ESR1MAOAHPGD
SCHEMBL20381251 0.78 ALOX5 (0.48) PPARAPPARGGPR84ALOX5HTT
SCHEMBL24325650 0.78 MEN1 (0.45) EGFRGPR84ALOX5HPGDPTGS2

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-11414534-B2 Multifunctional optically highly transparent films and method for their production ISLAND POLYMER INDUSTRIES GMBH (DE) 2022-08-16 US disclosed