SCHEMBL16022378

SCHEMBL16022378

OCCCC1(CO)c2ccccc2-c2ccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)cc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 17/20 0.38
▸ APEX1 P27695 1/20 0.32
▸ CRHBP P24387 1/20 0.32
▸ CRHR2 Q13324 1/20 0.32
▸ KEAP1 Q14145 1/20 0.32
▸ NFE2L2 Q16236 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL16022399 0.97 PDK2 (0.37) PDK2CRHBPCRHR2KEAP1NFE2L2
SCHEMBL16022413 0.91 PDK2 (0.33) PDK2CRHBPCRHR2KEAP1NFE2L2
SCHEMBL16025158 0.89 PDK2 (0.36) PDK2APEX1CRHBPCRHR2KEAP1
SCHEMBL16022391 0.88 PDK2 (0.36) PDK2APEX1
SCHEMBL16017945 0.87 PDK2 (0.34) PDK2APEX1
SCHEMBL16017969 0.87 PDK2 (0.42) PDK2CRHBPCRHR2KEAP1NFE2L2
SCHEMBL16025161 0.86 PDK2 (0.36) PDK2CRHBPCRHR2KEAP1NFE2L2
SCHEMBL16022393 0.85 PDK2 (0.35) PDK2
SCHEMBL16017913 0.85 PDK2 (0.39) PDK2APEX1
SCHEMBL16025184 0.83 PDK2 (0.39) PDK2APEX1CRHBPCRHR2KEAP1

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-9316931-B2 Electrophotographic photosensitive member, electrophotographic apparatus, process cartridge, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2016-04-19 — — US disclosed
US-20140255836-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND ELECTROPHOTOGRAPHIC APPARATUS AND PROCESS CARTRIDGE EACH INCLUDING THE ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER CANON KABUSHIKI KAISHA (JP) 2014-09-11 — — US disclosed
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