SCHEMBL9009727

SCHEMBL9009727

CCN(C)c1cccc(N=Nc2cc(Cl)c(S(=O)(=O)F)cc2Cl)c1N1C(=O)c2cccc(Cl)c2C1=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 1/20 0.32
GRM7 Q14831 1/20 0.32
GRM4 Q14833 1/20 0.32
ANPEP P15144 1/20 0.31
DPP4 P27487 1/20 0.31

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
SCHEMBL7772224 0.80 CA2 (0.31)
SCHEMBL7768240 0.70 KMT2A (0.45) GRM1GRM7GRM4ANPEPDPP4
SCHEMBL8728990 0.68 MEN1 (0.30)
SCHEMBL11022012 0.63 DPP4 (0.68) GRM1GRM7GRM4ANPEPDPP4
SCHEMBL14944896 0.63 MAPT (0.39)
SCHEMBL3821275 0.62 DPP4 (0.51) GRM1GRM7GRM4ANPEPDPP4
SCHEMBL14945025 0.60 MAPT (0.33)
SCHEMBL19365931 0.60 DPP4 (0.55) GRM1GRM7GRM4ANPEPDPP4
SCHEMBL3819535 0.59 DPP4 (0.47) GRM1GRM7GRM4ANPEPDPP4
SCHEMBL11018727 0.58 DPP4 (0.69) GRM1GRM7GRM4ANPEPDPP4

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-0740690-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF ZENECA LIMITED (GB) 1996-11-06 EP disclosed
WO-1995020014-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF ZENECA LIMITED (GB) 1995-07-27 WO disclosed