SCHEMBL1345490

SCHEMBL1345490

CCc1ccc(O)c(C(C)c2cc(CC)cc(C(C)c3cc(CC)ccc3O)c2O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.52
ALOX12 P18054 5/20 0.39
ALOX15 P16050 4/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 4/20 0.39
POLB P06746 3/20 0.39
USP2 O75604 3/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
ESR1 P03372 2/20 0.39
TP53 P04637 2/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
RECQL P46063 2/20 0.39
KMT2A Q03164 2/20 0.39
HIF1A Q16665 2/20 0.39
CNR1 P21554 2/20 0.39
NR3C1 P04150 2/20 0.39

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
SCHEMBL1345250 1.00 TRPA1 (0.52) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1345528 1.00 TRPA1 (0.52) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1345055 1.00 TRPA1 (0.52) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL51701 0.93 TRPA1 (0.59) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1345562 0.83 CNR1 (0.53) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1345502 0.83 CNR1 (0.53) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1344744 0.83 CNR1 (0.53) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL1345947 0.83 CNR1 (0.53) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL5166554 0.81 TRPA1 (0.59) TRPA1ALOX12ALOX15KDM4EALDH1A1
SCHEMBL29668422 0.79 TYR (0.51) TRPA1ALOX12ALOX15KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724119-B1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS MITSUBISHI CHEM CORP (JP) 2014-11-19 EP disclosed
US-8062993-B2 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2011-11-22 US disclosed
US-20070173407-A1 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2007-07-26 US disclosed
EP-1724119-A1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS API Corporation (JP) 2006-11-22 EP disclosed