SCHEMBL19984030

SCHEMBL19984030

CNCc1c[nH]c2cc(Nc3ccc(F)cc3Cl)ccc12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.48
MPO P05164 2/20 0.41
HTR2A P28223 4/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HTR1A P08908 1/20 0.40
ALKBH5 Q6P6C2 2/20 0.40
FTO Q9C0B1 2/20 0.40
HTR6 P50406 2/20 0.36
HTR2C P28335 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
SLC6A4 P31645 2/20 0.36
KCNH2 Q12809 2/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL19984003 0.88 GPR84 (0.50) GPR84MPOHTR2AHTR1AALKBH5
SCHEMBL19983715 0.87 HTR2A (0.42) GPR84HTR2AALKBH5FTOCHRNB2
SCHEMBL19983891 0.87 GPR84 (0.49) GPR84MPOHTR2AHTR1AALKBH5
SCHEMBL19983739 0.86 CHRNB2 (0.50) GPR84HTR2ACHRNB2CHRNA7CHRNA4
SCHEMBL19983748 0.86 GPR84 (0.50) GPR84MPOHTR2AHTR1AALKBH5
SCHEMBL19983765 0.86 GPR84 (0.43) GPR84MPOHTR2ASLC6A2SLC6A3
SCHEMBL19983945 0.85 TBXAS1 (0.41) GPR84HTR2AHTR1ASLC6A4KCNH2
SCHEMBL19984001 0.84 MAPK8 (0.48) GPR84HTR2ASLC6A2SLC6A3HTR1A
SCHEMBL19983989 0.84 GPR84 (0.46) GPR84MPOHTR2AHTR1AALKBH5
SCHEMBL19984119 0.84 GPR84 (0.53) GPR84MPOHTR2AHTR1AALKBH5

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