SCHEMBL19983849

SCHEMBL19983849

CNCc1c[nH]c2cc(Nc3cc(F)c(C)cc3F)ccc12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.40
CHRNB2 P17787 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
HTR2A P28223 3/20 0.36
APP P05067 2/20 0.35
MPO P05164 2/20 0.34
STING1 Q86WV6 1/20 0.34
ALKBH5 Q6P6C2 2/20 0.34
FTO Q9C0B1 2/20 0.34
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
NR3C1 P04150 1/20 0.33
HTR1A P08908 1/20 0.33
CFTR P13569 1/20 0.32

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
SCHEMBL19983944 0.92 GPR84 (0.40) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19984124 0.91 GPR84 (0.42) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983754 0.86 HTR2A (0.45) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983758 0.85 GPR84 (0.37) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19984003 0.84 GPR84 (0.50) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983748 0.84 GPR84 (0.50) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19984153 0.83 GPR84 (0.40) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983891 0.83 GPR84 (0.49) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983751 0.83 GPR84 (0.40) GPR84CHRNB2CHRNA7CHRNA4HTR2A
SCHEMBL19983738 0.82 GPR84 (0.39) GPR84CHRNB2CHRNA7CHRNA4HTR2A

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