SCHEMBL16601771

SCHEMBL16601771

CCc1cccc(CC)c1N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1ccc(CC(=O)O)cc1)C5=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.49
CYP1A2 P05177 2/20 0.47
CYP2D6 P10635 1/20 0.47
ANPEP P15144 2/20 0.46
DPP4 P27487 2/20 0.46
KDM4E B2RXH2 5/20 0.45
POLB P06746 5/20 0.45
ALDH1A1 P00352 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP6 P55212 3/20 0.41
CTDSP1 Q9GZU7 2/20 0.41
NSD2 O96028 1/20 0.41
GRK2 P25098 1/20 0.41
PPARA Q07869 4/20 0.41
PPARD Q03181 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
RECQL P46063 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40

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
SCHEMBL8070665 0.83 ANPEP (0.59) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL16601821 0.82 ANPEP (0.48) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL16601804 0.81 KDM4E (0.51) CYP1A2ANPEPDPP4KDM4EALDH1A1
SCHEMBL16601832 0.78 ANPEP (0.50) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL16601770 0.78 NPC1 (0.66) ANPEPDPP4KDM4EPOLBALDH1A1
SCHEMBL16601630 0.78 ANPEP (0.54) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL22221562 0.77 ANPEP (0.66) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL16601655 0.76 ANPEP (0.52) CYP1A2ANPEPDPP4KDM4EPOLB
SCHEMBL16601822 0.76 ANPEP (0.50) CYP2D6ANPEPDPP4KDM4EPOLB
SCHEMBL24976892 0.75 ANPEP (0.51) CYP1A2ANPEPDPP4KDM4EPOLB

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-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