SCHEMBL9530535

SCHEMBL9530535

CCCCCCCSc1nnc(N)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 1.00
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 2/20 0.54
HPGD P15428 2/20 0.54
NPC1 O15118 1/20 0.54
MAPT P10636 1/20 0.54
RAB9A P51151 1/20 0.54
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FBP1 P09467 1/20 0.45

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
SCHEMBL10559488 1.00 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL4399146 1.00 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL9579065 0.93 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL2772386 0.87 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL11423947 0.87 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL7797173 0.87 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL28887982 0.87 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL8479039 0.85 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL10797452 0.85 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2LMNAHPGDNPC1
SCHEMBL11784718 0.83 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2LMNAHPGDNPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117355516-A Small molecules for the treatment of kinase-related diseases 阿索斯治疗公司 2024-01-05 CN disclosed
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