SCHEMBL16601641

SCHEMBL16601641

CCc1cccc(C)c1N1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(c1ccc(CCO)cc1)C3=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP1A2 P05177 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ANPEP P15144 4/20 0.44
DPP4 P27487 4/20 0.44
NR1H3 Q13133 5/20 0.41
APAF1 O14727 1/20 0.40
PPARA Q07869 4/20 0.39
PPARD Q03181 3/20 0.39
PPARG P37231 1/20 0.39
NR1H2 P55055 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL16602003 0.91 ALDH1A1 (0.48) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL16601668 0.85 POLB (0.59) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL13045764 0.83 DPP4 (0.55) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL16601669 0.81 DPP4 (0.44) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL16866477 0.81 POLB (0.59) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL16602024 0.80 DPP4 (0.50) ALDH1A1KDM4EANPEPDPP4MEN1
SCHEMBL12656452 0.79 DPP4 (0.50) ALDH1A1POLBKDM4EHPGDANPEP
SCHEMBL17263572 0.77 MEN1 (0.52) ALDH1A1CYP1A2CYP2C19TDP1ANPEP
SCHEMBL16601644 0.77 DPP4 (0.47) ALDH1A1POLBKDM4ECYP1A2HPGD
SCHEMBL16601663 0.77 KDM4E (0.58) ALDH1A1POLBKDM4ETDP1ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed