SCHEMBL306786

SCHEMBL306786

O=C1NC(=O)c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)N(c1ccc(N=Nc2ccccc2)cc1)C5=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
APAF1 O14727 1/20 0.42
ENPP2 Q13822 1/20 0.41
ALDH1A1 P00352 6/20 0.41
KMT2A Q03164 5/20 0.41
KDM4E B2RXH2 5/20 0.41
USP2 O75604 4/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KEAP1 Q14145 2/20 0.41
NFE2L2 Q16236 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
RECQL P46063 2/20 0.39
CASP6 P55212 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
MEN1 O00255 4/20 0.39
LMNA P02545 2/20 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
SCHEMBL29354753 0.92 POLB (0.49) POLBAPAF1ENPP2ALDH1A1KMT2A
SCHEMBL361483 0.92 POLB (0.49) POLBAPAF1ENPP2ALDH1A1KMT2A
SCHEMBL18103406 0.92 POLB (0.49) POLBAPAF1ENPP2ALDH1A1KMT2A
SCHEMBL30721003 0.92 POLB (0.49) POLBAPAF1ENPP2ALDH1A1KMT2A
SCHEMBL293983 0.92 POLB (0.49) POLBAPAF1ENPP2ALDH1A1KMT2A
SCHEMBL7597209 0.87 KDM4E (0.51) POLBAPAF1ALDH1A1KMT2AKDM4E
SCHEMBL7597013 0.87 KDM4E (0.51) POLBAPAF1ALDH1A1KMT2AKDM4E
SCHEMBL7598895 0.87 KDM4E (0.51) POLBAPAF1ALDH1A1KMT2AKDM4E
SCHEMBL14369577 0.81 ALDH1A1 (0.53) POLBAPAF1ALDH1A1KMT2AKDM4E
SCHEMBL7597251 0.78 ALDH1A1 (0.60) POLBAPAF1ALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8092963-B2 Toner compositions XEROX CORPORATION (US) 2012-01-10 US claimed