SCHEMBL9533487

SCHEMBL9533487

CCCCCCCSc1nn2cc(C#C[Si](C)(C)C)c(=O)nc2s1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
F2RL3 Q96RI0 1/20 0.34
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR84 Q9NQS5 8/20 0.31
KDM6B O15054 1/20 0.31
KDM4A O75164 1/20 0.31
KDM4D Q6B0I6 1/20 0.31
KDM3B Q7LBC6 1/20 0.31
HIF1AN Q9NWT6 1/20 0.31

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
SCHEMBL9530754 0.86 TSHR (0.43) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9536687 0.86 ALDH1A1 (0.36) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9532551 0.80 ALDH1A1 (0.38) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9534199 0.78 GPR84 (0.38) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9531038 0.78 GPR84 (0.38) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9532877 0.78 SOAT1 (0.40) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9533481 0.77 MAPT (0.41) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9531981 0.72 NPC1 (0.41) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9532173 0.68 RAB9A (0.42) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL9531244 0.68 NPC1 (0.42) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A

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