SCHEMBL6009237

SCHEMBL6009237

[CH]=Cc1ccc(C=C(OC)c2cc[c]c(OCC(CC)CCCC)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 4/20 0.33
MAPK1 P28482 2/20 0.33
TSHR P16473 1/20 0.33
CYP3A4 P08684 2/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL45309 0.81 ALDH1A1 (0.36) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL4560099 0.80 ALDH1A1 (0.39) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL55940 0.80 ALDH1A1 (0.39) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL2965177 0.76 ALDH1A1 (0.44) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL7738026 0.73
SCHEMBL4551543 0.70 TDP1 (0.35) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL27639365 0.70 ALDH1A1 (0.39) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL178113 0.69 ALDH1A1 (0.44) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL2478551 0.68 TDP1 (0.38) TDP1ALDH1A1MAPK1TSHRCYP3A4
SCHEMBL3457667 0.68

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-1646059-A2 Highly efficient counter electrode for dye-sensitized solar cell and method of producing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2006-04-12 EP claimed
US-20060070651-A1 Highly efficient counter electrode for dye-sensitized solar cell and method of producing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2006-04-06 US claimed
EP-1646059-A2 Highly efficient counter electrode for dye-sensitized solar cell and method of producing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2006-04-12 EP disclosed
US-20060070651-A1 Highly efficient counter electrode for dye-sensitized solar cell and method of producing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2006-04-06 US disclosed