SCHEMBL4742936

SCHEMBL4742936

CC(=O)C(N=Nc1c(C#N)cnn1-c1ncccn1)C(=O)Nc1ccccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
KMT2A Q03164 2/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
PGR P06401 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
KDM4E B2RXH2 2/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HPGD P15428 4/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GFER P55789 1/20 0.31
POLB P06746 1/20 0.31
PTGS1 P23219 1/20 0.31

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
SCHEMBL4742973 0.90 LMNA (0.36) LMNAKMT2ANPC1RAB9APKM
SCHEMBL4742942 0.90 HTT (0.36) KMT2ANPC1RAB9AL3MBTL1KDM4E
SCHEMBL4742945 0.89 IRAK4 (0.38) KMT2ANPC1RAB9APKML3MBTL1
SCHEMBL4742957 0.89 GFER (0.40) KMT2ANPC1RAB9AKDM4ETSHR
SCHEMBL4742963 0.88 HTT (0.36) LMNAKMT2ANPC1RAB9AL3MBTL1
SCHEMBL4742949 0.88 PKM (0.39) LMNAKMT2APKMKDM4ETSHR
SCHEMBL4742955 0.88 KDM4E (0.41) LMNAKMT2AKDM4ETSHRHSD17B10
SCHEMBL4781297 0.88 PANK3 (0.34) PKMTSHRPTGS1PTGS2
SCHEMBL4742972 0.87 POLB (0.41) KMT2ANPC1RAB9APKMHPGD
SCHEMBL4781307 0.86 GRM4 (0.32) L3MBTL1KDM4EHPGDGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8177861-B2 AZO pigment, pigment dispersion containing the AZO pigment, and coloring composition FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
US-8177861-B2 AZO pigment, pigment dispersion containing the AZO pigment, and coloring composition FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed