SCHEMBL16626544

SCHEMBL16626544

CNCc1c[nH]c2cc(Nc3ccc(OC)nc3Cl)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.36
CYP2C9 P11712 1/20 0.36
HTR2A P28223 2/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
MTNR1A P48039 3/20 0.34
MTNR1B P49286 3/20 0.34
PRKAG1 P54619 1/20 0.34
PRKAA1 Q13131 1/20 0.34
PRKAB1 Q9Y478 1/20 0.34
ULK1 O75385 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1B Q00975 1/20 0.33
HTR6 P50406 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
SCHEMBL19984050 0.90 CYP1A2 (0.42) GPR84CYP2C9HTR2AMTNR1AMTNR1B
SCHEMBL19984013 0.89 HTR2A (0.35) CYP2C9HTR2ACHRNB2CHRNA7CHRNA4
SCHEMBL19983894 0.87 GPR84 (0.39) GPR84CYP2C9HTR2ACHRNB2CHRNA7
SCHEMBL19983877 0.83 GPR84 (0.36) GPR84HTR2ACHRNB2CHRNA7CHRNA4
SCHEMBL19983764 0.82 APP (0.38) GPR84CYP2C9CHRNB2CHRNA7CHRNA4
SCHEMBL19983815 0.81 CYP2C9 (0.43) GPR84CYP2C9HTR2ACHRNB2CHRNA7
SCHEMBL19984194 0.80 GPR84 (0.39) GPR84HTR2ACHRNB2CHRNA7CHRNA4
SCHEMBL19983880 0.80 MEN1 (0.36) GPR84HTR2ACHRNB2CHRNA7CHRNA4
SCHEMBL19984147 0.78 CYP2D6 (0.36) GPR84CYP2C9HTR2ACHRNB2CHRNA7
SCHEMBL19983771 0.78 CHRNB2 (0.38) GPR84HTR2ACHRNB2CHRNA7CHRNA4

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 2 patents. 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
WO-2015050412-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-04-09 WO disclosed