SCHEMBL4742963

SCHEMBL4742963

CC(=O)C(N=Nc1c(C#N)cnn1-c1ncccn1)C(=O)Nc1cccnc1Cl

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RAB9A P51151 5/20 0.35
NPC1 O15118 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
POLB P06746 1/20 0.34
KCNJ11 Q14654 1/20 0.34
P2RX7 Q99572 1/20 0.34
KMT2A Q03164 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
CNR1 P21554 1/20 0.33
OPRM1 P35372 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL4742942 0.91 HTT (0.36) HTTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4781307 0.89 GRM4 (0.32) ALDH1A1L3MBTL1GAAPTGS1PTGS2
SCHEMBL4742936 0.88 LMNA (0.38) RAB9ANPC1ALDH1A1LMNAMAPT
SCHEMBL4742972 0.88 POLB (0.41) HTTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4781297 0.87 PANK3 (0.34) PTGS1PTGS2
SCHEMBL4742957 0.86 GFER (0.40) HTTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4742945 0.86 IRAK4 (0.38) SMN1; SMN2RAB9ANPC1ALDH1A1MAPT
SCHEMBL4742955 0.85 KDM4E (0.41) HTTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL4742949 0.85 PKM (0.39) SMN1; SMN2ALDH1A1LMNAMAPTKMT2A
SCHEMBL4768142 0.84 GRM4 (0.31)

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