SCHEMBL9532877

SCHEMBL9532877

CCCCCCCSc1nn2cc(OC)c(=O)nc2s1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.40
G6PD P11413 1/20 0.38
F2RL3 Q96RI0 9/20 0.37
ALDH1A1 P00352 1/20 0.36
MAPT P10636 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 2/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2E1 P05181 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C8 P10632 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2B6 P20813 2/20 0.34
CYP2C19 P33261 2/20 0.34

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
SCHEMBL9532551 0.83 ALDH1A1 (0.38) F2RL3ALDH1A1MAPTNPC1RAB9A
SCHEMBL9534199 0.81 GPR84 (0.38) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9531038 0.81 GPR84 (0.38) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9530754 0.81 TSHR (0.43) F2RL3ALDH1A1MAPTNPC1RAB9A
SCHEMBL9536687 0.81 ALDH1A1 (0.36) F2RL3ALDH1A1MAPTNPC1RAB9A
SCHEMBL9533487 0.78 ALDH1A1 (0.34) F2RL3ALDH1A1MAPTNPC1RAB9A
SCHEMBL9523990 0.77 POLB (0.49) F2RL3ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL9531981 0.76 NPC1 (0.41) SOAT1ALDH1A1MAPTNPC1RAB9A
SCHEMBL9532867 0.75 MAPT (0.44) SOAT1G6PDALDH1A1MAPTNPC1
SCHEMBL9531244 0.71 NPC1 (0.42) ALDH1A1MAPTNPC1RAB9ASMN1; 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