SCHEMBL17509802

SCHEMBL17509802

CCCCCCCCCC(CCCCC)CCCCc1c(O)cccc1OC

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.51
PTGS2 P35354 1/20 0.51
CNR1 P21554 7/20 0.47
CNR2 P34972 7/20 0.47
HTR1A P08908 1/20 0.46
PPARA Q07869 1/20 0.46
SLC2A1 P11166 1/20 0.44
ELANE P08246 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL27894235 0.91 ALOX5 (0.59) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL7044011 0.90 ALOX5 (0.61) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL17509786 0.88 CNR1 (0.51) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL17509780 0.87 BID (0.46) PPARAALDH1A1LMNAMAPT
SCHEMBL59744 0.85 ALOX5 (0.54) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL31327375 0.85 ALOX5 (0.54) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL7210174 0.84 ALOX5 (0.53) ALOX5PTGS2CNR1CNR2PPARA
SCHEMBL9814049 0.80 ALOX5 (0.59) ALOX5PTGS2PPARASLC2A1ELANE
SCHEMBL9814043 0.80 ALOX5 (0.59) ALOX5PTGS2PPARASLC2A1ELANE
SCHEMBL9814061 0.80 ALOX5 (0.59) ALOX5PTGS2PPARASLC2A1ELANE

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-20160083513-A1 POLYCARBONATE RESIN FOR LIQUID CRYSTAL MEMBERS, POLYCARBONATE RESIN COMPOSITION FOR LIQUID CRYSTAL MEMBERS WHICH CONTAINS SAME, AND LIQUID CRYSTAL MEMBER IDEMITSU KOSAN CO., LTD. (JP) 2016-03-24 US disclosed
EP-2987816-A1 POLYCARBONATE RESIN FOR LIQUID CRYSTAL MEMBERS, POLYCARBONATE RESIN COMPOSITION FOR LIQUID CRYSTAL MEMBERS WHICH CONTAINS SAME, AND LIQUID CRYSTAL MEMBER Idemitsu Kosan Co., Ltd (JP) 2016-02-24 EP disclosed