SCHEMBL9530837

SCHEMBL9530837

Cc1cc(=O)nc2sc(SCc3ccc(Cl)cc3)nn12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 5/20 0.63
HTT P42858 4/20 0.63
GFER P55789 1/20 0.50
POLB P06746 1/20 0.47
CDK2 P24941 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 3/20 0.42
CA1 P00915 1/20 0.41
EGFR P00533 1/20 0.41
MET P08581 1/20 0.41
DHODH Q02127 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL9530831 0.83 HTT (0.63) PKMHTTGFERPOLBCDK2
SCHEMBL9776424 0.78 PKM (0.55) PKMHTTGFERPOLBCDK2
SCHEMBL9523107 0.73 PKM (0.55) PKMHTTGFERPOLBCDK2
SCHEMBL9776477 0.73 PKM (0.55) PKMHTTGFERPOLBCDK2
SCHEMBL4403129 0.72 CA12 (0.38) PKMHTTPOLBL3MBTL1ALDH1A1
SCHEMBL9524992 0.71 PKM (0.65) PKMHTTGFERPOLBCDK2
SCHEMBL9776423 0.71 PKM (0.55) PKMHTTGFERPOLBCDK2
SCHEMBL11004662 0.71 HTT (0.48) PKMHTTGFERPOLBCYP1A2
SCHEMBL9525566 0.71 PKM (0.52) PKMHTTGFERPOLBCDK2
SCHEMBL9776415 0.71 PKM (0.52) PKMHTTGFERPOLBCDK2

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