SCHEMBL14044100

SCHEMBL14044100

CCCCn1c(O)c(/N=N/c2cccc(C)c2)c(C)c(C#N)c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.55
MEN1 O00255 11/20 0.55
KMT2A Q03164 11/20 0.55
LMNA P02545 1/20 0.55
KDM4E B2RXH2 4/20 0.46
MITF O75030 1/20 0.46
THRB P10828 1/20 0.46
ALDH1A1 P00352 3/20 0.46
PKM P14618 1/20 0.46
ALPL P05186 2/20 0.45
ALPG P10696 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.42
PHGDH O43175 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 2/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL9816832 0.89 KMT2A (0.66) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL13451305 0.88 MAPT (0.52) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL25486827 0.88 MAPT (0.52) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL14267906 0.84 KMT2A (0.53) MAPTMEN1KMT2AKDM4EMITF
SCHEMBL9490131 0.84 KMT2A (0.53) MAPTMEN1KMT2AKDM4EMITF
SCHEMBL25414323 0.84 KMT2A (0.53) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL26315649 0.84 KMT2A (0.53) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL21400506 0.83 KMT2A (0.53) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL13451304 0.82 KMT2A (0.52) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL9491548 0.82 KMT2A (0.54) MAPTMEN1KMT2AKDM4EMITF

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
EP-1975203-A1 Alkynyl aniline based azo dyes, and their use with nionic azo metal complex dyes Clariant International Ltd. (CH) 2008-10-01 EP disclosed