SCHEMBL22563941

SCHEMBL22563941

CCc1cccc(C(=O)NCl)c1COc1ccn(S)n1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.31
SGMS2 Q8NHU3 1/20 0.31
GABRA5 P31644 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL22564142 0.93 ADORA3 (0.31) NR1H4PTGDR2
SCHEMBL22564127 0.90
SCHEMBL22564173 0.90 LMNA (0.34) NR1H4SGMS2GABRA5PTGDR2
SCHEMBL22564310 0.90 PDE5A (0.34) NR1H4SGMS2GABRA5
SCHEMBL18504547 0.88 SGMS2 (0.32) NR1H4SGMS2MRGPRX4PTGDR2
SCHEMBL22563950 0.88 SGMS2 (0.38) NR1H4SGMS2PTGDR2
SCHEMBL20845053 0.87 NR1H4 (0.33) NR1H4MRGPRX4
SCHEMBL22564540 0.87 HCRTR1 (0.38)
SCHEMBL22564171 0.86 ALDH1A1 (0.39)
SCHEMBL22564531 0.86 SGMS2 (0.38) NR1H4SGMS2

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed