SCHEMBL3826368

SCHEMBL3826368

CCCCCCCCCCCCCCCCCCCCCCc1cc(COP(=O)(O)O)cc(CCCC)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 5/20 0.48
▸ PTGS2 P35354 5/20 0.48
▸ S1PR1 P21453 7/20 0.44
▸ S1PR3 Q99500 7/20 0.44
▸ S1PR4 O95977 6/20 0.44
▸ S1PR5 Q9H228 5/20 0.44
▸ S1PR2 O95136 3/20 0.44
▸ LPAR3 Q9UBY5 3/20 0.44
▸ LPAR1 Q92633 2/20 0.44
▸ LPAR2 Q9HBW0 2/20 0.44
▸ CETP P11597 3/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TYR P14679 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL28050116 0.96 S1PR1 (0.42) ALOX5PTGS2S1PR1S1PR3S1PR4
SCHEMBL5094522 0.85 CETP (0.42) ALOX5PTGS2S1PR1S1PR3CETP
SCHEMBL3233483 0.81 ESR1 (0.41) S1PR1S1PR3LPAR3LPAR1LPAR2
SCHEMBL17865610 0.81 ALOX5 (0.40) ALOX5PTGS2CETPCYP3A4TYR
SCHEMBL15809436 0.79 TSHR (0.42) ALOX5PTGS2CETPTYRTSHR
SCHEMBL17510123 0.79 ALOX5 (0.38) ALOX5PTGS2S1PR1S1PR3CETP
SCHEMBL9000742 0.78 KAT8 (0.51) PTGS2S1PR1S1PR3S1PR4S1PR5
SCHEMBL11773665 0.78 PTGS2 (0.62) ALOX5PTGS2MEN1TP53CYP3A4
SCHEMBL200576 0.78 PTGS2 (0.62) ALOX5PTGS2MEN1TP53CYP3A4
SCHEMBL7985811 0.78 PTGS2 (0.62) ALOX5PTGS2MEN1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090135345-A1 Polarizing Plate Protective Film, Film Producing Method, Polarizing Plate, and Liquid Crystal Display KONICA MINOLTA OPTO, INC. (JP) 2009-05-28 — — US disclosed
US-20060078754-A1 Optical film, polarizing plate and display KONICA MINOLTA OPTO, INC. (JP) 2006-04-13 — — US disclosed
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