SCHEMBL4743340

SCHEMBL4743340

COc1ccccc1NC(=O)C(N=Nc1c(C#N)cnn1-c1ccccc1)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
ADORA3 P0DMS8 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.38
NR3C1 P04150 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
PDE9A O76083 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL4742957 0.90 GFER (0.40) MAPTSMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL4771695 0.89 PDE9A (0.37) MAPTSMN1; SMN2USP2LMNAALDH1A1
SCHEMBL4742858 0.89 ALDH1A1 (0.42) MAPTSMN1; SMN2USP2ALDH1A1HTT
SCHEMBL4771692 0.89 SMN1; SMN2 (0.38) MAPTSMN1; SMN2LMNAALDH1A1HTT
SCHEMBL4771687 0.88 PDE9A (0.37) MAPTSMN1; SMN2USP2LMNAALDH1A1
SCHEMBL4742934 0.87 SPR (0.40) MAPTSMN1; SMN2USP2ALDH1A1HTT
SCHEMBL4742958 0.87 KDM4E (0.43) MAPTSMN1; SMN2USP2ALDH1A1HTT
SCHEMBL4742951 0.85 MAPT (0.37) MAPTSMN1; SMN2USP2ALDH1A1HTT
SCHEMBL4780174 0.85 GFER (0.41) MAPTSMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL4743003 0.84 RAB9A (0.48) MAPTSMN1; SMN2LMNAALDH1A1HTT

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