SCHEMBL4743035

SCHEMBL4743035

[C-]#[N+]c1cnn(-c2nnc(-n3ncc(C#N)c3N=NC(C(C)=O)C(=O)Nc3ccccc3OC)s2)c1N=NC(C(C)=O)C(=O)Nc1ccccc1CO

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.33
KMT2A Q03164 6/20 0.33
PSMD14 O00487 1/20 0.33
PKM P14618 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
GAA P10253 1/20 0.32
HSD17B10 Q99714 2/20 0.32
HTT P42858 1/20 0.31
POLB P06746 2/20 0.30
USP2 O75604 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
SMN1; SMN2 Q16637 3/20 0.30
ALDH1A1 P00352 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL4743031 0.90 MEN1 (0.33) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4743017 0.90 MEN1 (0.33) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4771692 0.88 SMN1; SMN2 (0.38) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4742889 0.86 CDK4 (0.35) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4742968 0.80 GFER (0.37) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4743003 0.78 RAB9A (0.48) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4743340 0.78 MAPT (0.44) MEN1KMT2AHTTPOLBUSP2
SCHEMBL4742951 0.77 MAPT (0.37) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4771687 0.77 PDE9A (0.37) MEN1KMT2APSMD14PKMRXFP1
SCHEMBL4742957 0.77 GFER (0.40) MEN1KMT2AHTTPOLBSMN1; SMN2

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-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