SCHEMBL12445339

SCHEMBL12445339

CCC(c1ccc(OC)cc1)c1ccc(OC(C)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.54
FAAH O00519 1/20 0.50
KMT2A Q03164 1/20 0.48
AKR1C3 P42330 3/20 0.48
AKR1C2 P52895 3/20 0.48
AKR1C1 Q04828 1/20 0.48
PTGS1 P23219 1/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
ESR1 P03372 1/20 0.46
HIF1A Q16665 1/20 0.46
ELANE P08246 1/20 0.46
FFAR1 O14842 1/20 0.46
BACE1 P56817 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CYP19A1 P11511 1/20 0.45
LDHA P00338 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL9699736 0.93 LMNA (0.53) CYP17A1FAAHKMT2ALMNAESR1
SCHEMBL13986172 0.91 CYP17A1 (0.47) CYP17A1FAAHKMT2AAKR1C3AKR1C2
SCHEMBL13986174 0.90 ELANE (0.53) CYP17A1FAAHKMT2AAKR1C3AKR1C2
SCHEMBL14580015 0.87 FAAH (0.48) FAAHKMT2AAKR1C3AKR1C2AKR1C1
SCHEMBL12521562 0.87 LMNA (0.47) FAAHPTGS1LMNAESR1HIF1A
SCHEMBL18053887 0.86 FFAR1 (0.46) CYP17A1FAAHKMT2AAKR1C3AKR1C2
SCHEMBL18053884 0.85 FFAR1 (0.45) CYP17A1FAAHKMT2AAKR1C3AKR1C2
SCHEMBL26009177 0.84 FAAH (0.52) FAAHKMT2ALMNAHPGDELANE
SCHEMBL18052479 0.84 FAAH (0.48) FAAHKMT2AAKR1C3AKR1C2AKR1C1
SCHEMBL18052470 0.84 KMT2A (0.46) FAAHKMT2AAKR1C3AKR1C2PTGS1

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-8865380-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2014-10-21 US disclosed
US-20110177438-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2011-07-21 US disclosed