SCHEMBL16601655

SCHEMBL16601655

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.52
DPP4 P27487 2/20 0.52
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 5/20 0.48
POLB P06746 3/20 0.48
HPGD P15428 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
APAF1 O14727 1/20 0.45
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
RAB9A P51151 3/20 0.41
CA12 O43570 3/20 0.41
CA9 Q16790 3/20 0.41
NPC1 O15118 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39

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
SCHEMBL16601821 0.95 ANPEP (0.48) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL22221562 0.86 ANPEP (0.66) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16601657 0.81 POLB (0.64) ALDH1A1KDM4EPOLBHPGDTDP1
SCHEMBL8070665 0.80 ANPEP (0.59) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16601608 0.80 ANPEP (0.59) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16601668 0.79 POLB (0.59) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16601675 0.78 KMT2A (0.58) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL13045764 0.77 DPP4 (0.55) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16602003 0.77 ALDH1A1 (0.48) ANPEPDPP4ALDH1A1KDM4EPOLB
SCHEMBL16601771 0.76 PTGER4 (0.49) ANPEPDPP4ALDH1A1KDM4EPOLB

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