SCHEMBL5315210

SCHEMBL5315210

Cc1cccc(C)c1NC(=O)c1cncc(-c2cccc(N)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.61
S1PR4 O95977 2/20 0.49
SCN10A Q9Y5Y9 5/20 0.47
BLK P51451 3/20 0.45
BTK Q06187 2/20 0.45
CTSA P10619 1/20 0.45
MAP4K4 O95819 1/20 0.45
KCNH2 Q12809 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SCN2A Q99250 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
MEN1 O00255 1/20 0.42
PSIP1 O75475 1/20 0.42
AXL P30530 1/20 0.42
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42

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
SCHEMBL5315263 0.89 CHRNA7 (0.69) CHRNA7S1PR4SCN10ACTSAKCNH2
SCHEMBL5315413 0.84 CHRNA7 (0.57) CHRNA7S1PR4SCN10ACTSASCN2A
SCHEMBL14573319 0.82 CHRNA7 (0.70) CHRNA7S1PR4SCN10ACTSAKCNH2
SCHEMBL5313064 0.81 CHRNA7 (0.66) CHRNA7S1PR4SCN10ACTSAKCNH2
SCHEMBL5312509 0.81 CHRNA7 (0.53) CHRNA7S1PR4SCN10ACTSASCN2A
SCHEMBL14494777 0.80 CHRNA7 (0.55) CHRNA7S1PR4SCN10ABTKCTSA
SCHEMBL5317038 0.79 BTK (0.57) CHRNA7BTK
SCHEMBL9789598 0.78 ALDH1A1 (0.68) S1PR4KDM4EALDH1A1MEN1
SCHEMBL14494779 0.78 CHRNA7 (0.53) CHRNA7S1PR4SCN10ACTSASCN2A
SCHEMBL6436030 0.78 CYP11B2 (0.58) ALDH1A1CDK8MEN1PSIP1AXL

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
WO-2007062459-A1 SELECTIVE KINASE INHIBITORS BASED ON PYRIDINE SCAFFOLD CYTOPIA RESEARCH PTY LTD (AU) 2007-06-07 WO disclosed