SCHEMBL172845

SCHEMBL172845

CCCCCCCC(C)C1CCCO1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.40
HPGD P15428 1/20 0.39
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
OPRM1 P35372 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL18825678 1.00 EPHX1 (0.40) EPHX1HPGDALDH1A1TDP1OPRM1
SCHEMBL8948314 0.98 EPHX1 (0.37) EPHX1HPGDALDH1A1OPRM1RAB9A
SCHEMBL9376107 0.93 EPHX1 (0.36) EPHX1HPGDALDH1A1TDP1OPRM1
SCHEMBL9720176 0.93 HPGD (0.38) EPHX1HPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL27811789 0.91 EPHX1 (0.48) EPHX1ALDH1A1TDP1OPRM1SPHK1
SCHEMBL11730302 0.91 EPHX1 (0.48) EPHX1ALDH1A1TDP1OPRM1SPHK1
SCHEMBL11777433 0.89 HPGD (0.39) HPGDALDH1A1RAB9ASMN1; SMN2HSD17B10
SCHEMBL11743390 0.87 HPGD (0.34) EPHX1HPGDALDH1A1TDP1
SCHEMBL19333960 0.84 EPHX1 (0.41) EPHX1HPGDALDH1A1TDP1
SCHEMBL11741223 0.83 HPGD (0.35) HPGDALDH1A1SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1521125-B1 Electrophotographic photoconductor, electrophotographic method, electrophotographic apparatus, process cartridge for electrophotographic apparatus and azo compound RICOH CO LTD (JP) 2012-03-07 EP disclosed