SCHEMBL9106812

SCHEMBL9106812

CCCCCCCCCCCCCCCCCCSC(C)CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.55
HSD17B10 Q99714 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
BLM P54132 1/20 0.50
GPR84 Q9NQS5 11/20 0.48
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43
PPARA Q07869 7/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
PTPN1 P18031 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43

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
SCHEMBL11268390 1.00 EPHX1 (0.55) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL13791456 0.92 EPHX1 (0.44) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL21313313 0.85 EPHX1 (0.55) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL9818160 0.84 GPR84 (0.36) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL28947405 0.83 EPHX1 (0.46) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL31361793 0.82 HSD17B10 (0.52) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL21596748 0.81 EPHX1 (0.51) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL21596738 0.81 EPHX1 (0.51) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL29436973 0.81 EPHX1 (0.51) EPHX1HSD17B10GMNNTP53POLB
SCHEMBL12483481 0.81 EPHX1 (0.51) EPHX1HSD17B10GMNNTP53POLB

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-8501312-B2 Charging member CANON KABUSHIKI KAISHA (JP) 2013-08-06 US disclosed
US-20120141161-A1 CHARGING MEMBER CANON KABUSHIKI KAISHA (JP) 2012-06-07 US disclosed