SCHEMBL16601657

SCHEMBL16601657

O=C1c2ccc3c4c(ccc(c24)C(=O)N1c1ccc(S)cc1)C(=O)N(c1ccc(S)cc1)C3=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.64
APAF1 O14727 1/20 0.64
CA9 Q16790 5/20 0.56
CA12 O43570 4/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 5/20 0.47
HPGD P15428 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 2/20 0.42
KEAP1 Q14145 2/20 0.42

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
SCHEMBL16601817 0.92 POLB (0.56) POLBAPAF1CA9CA12CA1
SCHEMBL16864825 0.83 POLB (0.47) POLBAPAF1CA9CA12CA1
SCHEMBL18566560 0.83 ALDH1A1 (0.70) POLBCA9CA12CA1CA2
SCHEMBL14011315 0.83 KMT2A (0.64) CA9CA12CA1CA2ALDH1A1
SCHEMBL20033857 0.81 POLB (0.45) POLBAPAF1CA9CA12CA1
SCHEMBL16601655 0.81 ANPEP (0.52) POLBAPAF1CA9CA12CA1
SCHEMBL22203806 0.78 MEN1 (0.70) POLBAPAF1CA9CA12CA1
SCHEMBL22203791 0.78 POLB (0.64) POLBAPAF1CA9CA12CA1
SCHEMBL12112509 0.78 POLB (1.00) POLBAPAF1CA9CA12CA1
SCHEMBL5533673 0.78 POLB (0.64) POLBAPAF1CA9CA12CA1

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