SCHEMBL9531901

SCHEMBL9531901

CCCCCCSc1nn2c(C#N)cc(=O)nc2s1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TSHR P16473 2/20 0.36
GAA P10253 2/20 0.36
HTT P42858 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GPR84 Q9NQS5 8/20 0.35
SCN9A Q15858 2/20 0.34
SCN5A Q14524 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL9531294 0.88 SMN1; SMN2 (0.42) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9533306 0.85 SMN1; SMN2 (0.45) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL10373988 0.83 SMN1; SMN2 (0.46) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9532617 0.82 SMN1; SMN2 (0.45) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9532047 0.82 SMN1; SMN2 (0.45) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9531893 0.82 KDM4E (0.44) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL10374717 0.78 NPC1 (0.51) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9530746 0.77 HTT (0.47) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL9533394 0.76 CA2 (0.40) MAPTALDH1A1KDM4EGAAMEN1
SCHEMBL10373986 0.76 MAPT (0.47) SMN1; SMN2NPC1MAPTRAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238059-B1 5H-1,3,4-Thiazole[3,2-a]pyrimidin-5-one derivatives and fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1993-06-16 EP disclosed
US-4971971-A FUNGICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-11-20 US disclosed
US-4866064-A AGRICULTURE HORTICULTURE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-09-12 US disclosed
EP-0282635-A2 5H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-5-one derivatives and fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-09-21 EP disclosed
EP-0238059-A2 5H-1,3,4-Thiazole[3,2-a]pyrimidin-5-one derivatives and fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-09-23 EP disclosed