SCHEMBL19984110

SCHEMBL19984110

CNCc1c[nH]c2cc(Nc3c(C)cc(Cl)cc3C)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.44
CHRNB2 P17787 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
RAPGEF4 Q8WZA2 8/20 0.38
SLC6A4 P31645 3/20 0.37
CFTR P13569 1/20 0.35
HTR2A P28223 3/20 0.35
SLC6A2 P23975 2/20 0.34
SLC6A3 Q01959 2/20 0.34
KCNH2 Q12809 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HTR2C P28335 2/20 0.33
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR1A P08908 1/20 0.33
HTT P42858 1/20 0.33
HTR2B P41595 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
SCHEMBL19983851 0.88 CHRNB2 (0.47) GPR84CHRNB2CHRNA7CHRNA4RAPGEF4
SCHEMBL19983983 0.88 GPR84 (0.44) GPR84CHRNB2CHRNA7CHRNA4RAPGEF4
SCHEMBL19984156 0.87 MEN1 (0.38) GPR84CHRNB2CHRNA7CHRNA4CFTR
SCHEMBL19983887 0.86 GPR84 (0.43) GPR84CHRNB2CHRNA7CHRNA4RAPGEF4
SCHEMBL19984216 0.86 GPR84 (0.48) GPR84CHRNB2CHRNA7CHRNA4SLC6A4
SCHEMBL19984197 0.85 GPR84 (0.49) GPR84CHRNB2CHRNA7CHRNA4SLC6A4
SCHEMBL19984193 0.82 GPR84 (0.37) GPR84CHRNB2CHRNA7CHRNA4SLC6A4
SCHEMBL19983765 0.81 GPR84 (0.43) GPR84CHRNB2CHRNA7CHRNA4SLC6A4
SCHEMBL19984000 0.80 HTR2A (0.46) GPR84CHRNB2CHRNA7CHRNA4CFTR
SCHEMBL19983984 0.79 GPR84 (0.41) GPR84CHRNB2CHRNA7CHRNA4SLC6A4

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-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed