SCHEMBL19983734

SCHEMBL19983734

CNCc1c[nH]c2cc(Nc3ccc(Oc4ccc(F)cc4)cc3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.46
MPO P05164 2/20 0.42
HTR2A P28223 10/20 0.41
SLC6A4 P31645 6/20 0.41
KCNH2 Q12809 4/20 0.41
TTBK1 Q5TCY1 1/20 0.39
TTBK2 Q6IQ55 1/20 0.39
MAPT P10636 1/20 0.39
HTR1A P08908 1/20 0.38
HTR2C P28335 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 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
SCHEMBL19984119 0.93 GPR84 (0.53) GPR84MPOHTR2AHTR1AHTR2C
SCHEMBL19983833 0.89 SCN9A (0.44) GPR84HTR2ASLC6A4MAPTHTR1A
SCHEMBL19984180 0.88 HTR2A (0.47) GPR84HTR2ASLC6A4KCNH2TTBK1
SCHEMBL19983831 0.85 HTR2A (0.49) GPR84HTR2AMAPT
SCHEMBL19984000 0.81 HTR2A (0.46) GPR84HTR2AMAPTHTR1ACHRNB2
SCHEMBL19983748 0.80 GPR84 (0.50) GPR84MPOHTR2AHTR1AHTR2C
SCHEMBL19984003 0.80 GPR84 (0.50) GPR84MPOHTR2AHTR1AHTR2C
SCHEMBL19984243 0.79 GPR84 (0.46) GPR84MPOHTR2AHTR1AHTR2C
SCHEMBL19983845 0.79 TBXAS1 (0.44) GPR84HTR2ASLC6A4KCNH2HTR1A
SCHEMBL31415127 0.79 GPR84 (0.72) GPR84MPOHTR2AHTR1AHTR2C

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