SCHEMBL9530831

SCHEMBL9530831

Cc1cc(=O)n2nc(SCc3ccc(Cl)cc3)sc2n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.63
PKM P14618 4/20 0.63
EGFR P00533 1/20 0.51
MET P08581 1/20 0.51
DHODH Q02127 1/20 0.51
GFER P55789 1/20 0.50
MAPT P10636 2/20 0.49
KMT2A Q03164 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
POLB P06746 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CDK2 P24941 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL9530837 0.83 PKM (0.63) HTTPKMEGFRMETDHODH
SCHEMBL9776423 0.78 PKM (0.55) HTTPKMGFERMAPTPOLB
SCHEMBL11004662 0.77 HTT (0.48) HTTPKMGFERMAPTPOLB
SCHEMBL9531992 0.75 MAPT (0.48) HTTPKMMAPTKMT2ARXFP1
SCHEMBL10997983 0.75 HTT (0.46) HTTPKMGFERMAPTKMT2A
SCHEMBL10373986 0.73 MAPT (0.47) HTTPKMMAPTKMT2APOLB
SCHEMBL9776474 0.73 PKM (0.55) HTTPKMGFERMAPTKMT2A
SCHEMBL9523098 0.73 PKM (0.55) HTTPKMGFERMAPTPOLB
SCHEMBL9776468 0.72 PKM (0.51) HTTPKMGFERMAPTPOLB
SCHEMBL9524992 0.71 PKM (0.65) HTTPKMGFERMAPTPOLB

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