SCHEMBL8570794

SCHEMBL8570794

O=C(O)Cc1nsc(NC(=O)c2ccccc2)n1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 7/20 0.62
NPC1 O15118 4/20 0.58
ALDH1A1 P00352 4/20 0.54
RXFP1 Q9HBX9 1/20 0.52
KDM4E B2RXH2 2/20 0.52
HTT P42858 1/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HSD17B10 Q99714 1/20 0.48
PDE5A O76074 1/20 0.48
RAB9A P51151 3/20 0.48
PKM P14618 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL8566680 0.86 NPSR1 (0.60) ADORA3NPC1ALDH1A1RXFP1KDM4E
SCHEMBL8565133 0.83 ALDH1A1 (0.61) ADORA3NPC1ALDH1A1RXFP1KDM4E
SCHEMBL8570862 0.83 ADORA3 (0.59) ADORA3NPC1ALDH1A1RXFP1KDM4E
SCHEMBL8570956 0.78 ADORA3 (0.53) ADORA3NPC1ALDH1A1RXFP1KDM4E
SCHEMBL29530821 0.77 ADORA3 (1.00) ADORA3NPC1RXFP1HTTMEN1
SCHEMBL1377141 0.77 ADORA3 (0.68) ADORA3NPC1RXFP1MEN1KMT2A
SCHEMBL8573205 0.76 ALDH1A1 (0.50) ADORA3NPC1ALDH1A1KDM4EHTT
SCHEMBL8575278 0.76 ADORA3 (0.51) ADORA3NPC1ALDH1A1RXFP1KDM4E
SCHEMBL8569581 0.74 ALDH1A1 (0.44) NPC1ALDH1A1KDM4EHTTMEN1
SCHEMBL8569286 0.74 KMT2A (0.44) NPC1ALDH1A1KDM4EPTGDR2MEN1

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