SCHEMBL19984015

SCHEMBL19984015

CNCc1c[nH]c2cc(Nc3ncccc3F)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 10/20 0.39
GPR84 Q9NQS5 1/20 0.38
TDO2 P48775 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 1/20 0.37
CHRNB2 P17787 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
SCHEMBL19983828 0.87 LMNA (0.38) GRM4GPR84GABRPGABRDGABRA1
SCHEMBL19983890 0.86 EGFR (0.43) GRM4GPR84GABRPGABRDGABRA1
SCHEMBL19984142 0.86 BACE1 (0.39) GRM4GPR84GABRPGABRDGABRA1
SCHEMBL19983769 0.86 TRPV1 (0.44) GRM4
SCHEMBL19983863 0.84 GPR84 (0.38) GRM4GPR84TDO2CHRNB2CHRNA7
SCHEMBL19983892 0.81 PTGS2 (0.46) GRM4GPR84TDO2CHRNB2CHRNA7
SCHEMBL19983904 0.80 GRM4 (0.45) GRM4
SCHEMBL19984119 0.78 GPR84 (0.53) GPR84CHRNB2CHRNA7CHRNA4
SCHEMBL19984195 0.78 LRRK2 (0.41) GRM4CHRNB2CHRNA7CHRNA4
SCHEMBL19984243 0.77 GPR84 (0.46) GPR84CHRNB2CHRNA7CHRNA4

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