SCHEMBL9532040

SCHEMBL9532040

CCCCCCSc1nn2c(=O)cc(I)nc2s1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 2/20 0.45
MAPT P10636 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALPL P05186 3/20 0.40
ALPI P09923 3/20 0.40
ALDH1A1 P00352 2/20 0.39
GPR84 Q9NQS5 8/20 0.37
USP2 O75604 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SCN9A Q15858 2/20 0.36
SCN5A Q14524 1/20 0.36

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
SCHEMBL10373986 0.86 MAPT (0.47) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9532602 0.85 KDM4E (0.46) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9533294 0.85 KDM4E (0.65) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9532047 0.83 SMN1; SMN2 (0.45) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9531893 0.82 KDM4E (0.44) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9531288 0.81 KDM4E (0.43) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL10373988 0.79 SMN1; SMN2 (0.46) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9531971 0.79 GPR84 (0.46) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9533306 0.78 SMN1; SMN2 (0.45) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9532617 0.78 SMN1; SMN2 (0.45) KDM4ENPC1MAPTRAB9ASMN1; SMN2

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