SCHEMBL9690773

SCHEMBL9690773

CSc1cccc(N(N)C2=NCCS2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
GRIN2B Q13224 2/20 0.37
GRIN2C Q14957 2/20 0.37
GRIN3A Q8TCU5 2/20 0.37
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
MAPT P10636 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HTT P42858 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
SCHEMBL9690093 0.82 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL9690716 0.78 ALDH1A1 (0.39) ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL9690700 0.78 ALDH1A1 (0.39) ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL9581166 0.78 ALDH1A1 (0.39) ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL11747051 0.76 ALDH1A1 (0.53) ALDH1A1NPSR1SMN1; SMN2NOS3NOS1
SCHEMBL9689448 0.75 ALDH1A1 (0.35) ALDH1A1NPSR1
SCHEMBL9690768 0.75 ALDH1A1 (0.50) ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL9689432 0.74 ALDH1A1 (0.36) ALDH1A1NPSR1
SCHEMBL9689560 0.74 ALDH1A1 (0.36) ALDH1A1NPSR1SMN1; SMN2
SCHEMBL9690026 0.74 TSHR (0.38) ALDH1A1SMN1; SMN2MAPTHSD17B10HTT

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-0520275-A2 2-(3-Substituted phenylhydrazino)-2-thiazoline and 2-(3-substituted phenylazo)-2-thiazoline, their preparation and their use against ectoparasites BAYER AG (DE) 1992-12-30 EP disclosed