SCHEMBL9530474

SCHEMBL9530474

Nc1nnc(Sc2ccccc2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
PKM P14618 1/20 0.53
PAX8 Q06710 1/20 0.53
ATM Q13315 1/20 0.53
FBP1 P09467 2/20 0.50
ALDH1A1 P00352 7/20 0.49
HSD17B10 Q99714 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 1/20 0.46
MAPT P10636 2/20 0.45
HPGD P15428 1/20 0.44
HDAC6 Q9UBN7 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL11784164 0.82 FBP1 (0.69) MAPK1NPSR1PKMPAX8ATM
SCHEMBL28461028 0.82 ALDH1A1 (0.53) MAPK1NPSR1PKMPAX8ATM
SCHEMBL10535557 0.81 FBP1 (0.72) MAPK1NPSR1FBP1ALDH1A1HSD17B10
SCHEMBL28460942 0.81 FBP1 (0.49) MAPK1NPSR1PKMPAX8ATM
SCHEMBL28451176 0.80 KDM4E (0.50) MAPK1NPSR1PKMPAX8ATM
SCHEMBL28451878 0.79 NPSR1 (0.52) MAPK1NPSR1PKMPAX8ATM
SCHEMBL28455463 0.77 FBP1 (0.45) MAPK1NPSR1PKMPAX8ATM
SCHEMBL28460988 0.77 ALDH1A1 (0.54) MAPK1NPSR1FBP1ALDH1A1HSD17B10
SCHEMBL28353371 0.76 MAPT (0.53) NPSR1PKMALDH1A1HSD17B10L3MBTL1
SCHEMBL28353372 0.74 HDAC6 (0.64) NPSR1PKMATMALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166159-B Compounds having PDE9A inhibiting activity and pharmaceutical uses thereof 韩国化学研究院 2023-10-24 CN disclosed
CN-113166159-A Compound with PDE9A inhibitory activity and pharmaceutical use thereof 韩国化学研究院 2021-07-23 CN disclosed
CN-107602548-B Myricetin derivative containing amide thioether thiadiazole, preparation method and application 贵州大学 2020-09-01 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
EP-0036081-A1 Azo dyestuffs as well as their preparation and their use in dyeing synthetic fibres BAYER AG (DE) 1981-09-23 EP disclosed
US-4001203-A Heavy metal complexes of azo dyestuffs containing a heterocyclic diazo component and the residue of 5-halogeno-2,3-dihydrozypyridine as coupling component CIBA-GEIGY AG (CH) 1977-01-04 US disclosed