SCHEMBL19984119

SCHEMBL19984119

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

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.53
MPO P05164 3/20 0.45
HTR2A P28223 2/20 0.44
HTR1A P08908 1/20 0.43
CHRNB2 P17787 1/20 0.42
CHRNA7 P36544 1/20 0.42
CHRNA4 P43681 1/20 0.42
ALKBH5 Q6P6C2 1/20 0.40
FTO Q9C0B1 1/20 0.40
PTGS2 P35354 1/20 0.39
HTR2C P28335 1/20 0.39
APP P05067 2/20 0.39
HTR6 P50406 1/20 0.39

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
SCHEMBL19983734 0.93 GPR84 (0.46) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19984000 0.87 HTR2A (0.46) GPR84HTR2AHTR1ACHRNB2CHRNA7
SCHEMBL19984003 0.86 GPR84 (0.50) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19983748 0.86 GPR84 (0.50) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19983845 0.85 TBXAS1 (0.44) GPR84HTR2AHTR1ACHRNB2CHRNA7
SCHEMBL19984243 0.85 GPR84 (0.46) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL31415127 0.85 GPR84 (0.72) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19983891 0.85 GPR84 (0.49) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19983983 0.84 GPR84 (0.44) GPR84MPOHTR2AHTR1ACHRNB2
SCHEMBL19984030 0.84 GPR84 (0.48) GPR84MPOHTR2AHTR1ACHRNB2

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