SCHEMBL8566729

SCHEMBL8566729

CO/N=C(\C(=O)O)c1nsc(NC(=O)c2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 8/20 0.53
RXFP1 Q9HBX9 1/20 0.48
MAPT P10636 5/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP2C9 P11712 1/20 0.42
SCD O00767 1/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL8566734 1.00 ADORA3 (0.53) ADORA3RXFP1MAPTNPC1RAB9A
SCHEMBL8572901 0.92 ADORA3 (0.55) ADORA3RXFP1MAPTNPC1RAB9A
SCHEMBL8572906 0.92 ADORA3 (0.55) ADORA3RXFP1MAPTNPC1RAB9A
SCHEMBL8571932 0.82 MAPT (0.40) ADORA3MAPTNPC1RAB9APKM
SCHEMBL8571928 0.82 MAPT (0.40) ADORA3MAPTNPC1RAB9APKM
SCHEMBL30911334 0.82 ADORA3 (0.61) ADORA3RXFP1MAPTNPC1RAB9A
SCHEMBL8567225 0.81 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2CYP2C9NPSR1
SCHEMBL8567222 0.81 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2CYP2C9NPSR1
SCHEMBL8573144 0.80 ADORA3 (0.62) ADORA3RXFP1MAPTNPC1RAB9A
SCHEMBL8988413 0.80 LMNA (0.38) ADORA3RXFP1MAPTNPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5705650-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO., LTD. (JP) 1998-01-06 US disclosed
US-5585494-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO. LTD. (JP) 1996-12-17 US disclosed
EP-0536900-A2 Process for preparing 1,2,4-Thiadiazole Derivatives KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1993-04-14 EP disclosed