SCHEMBL9569356

SCHEMBL9569356

NC(=O)CN1C(c2ccc(Cl)cc2)=CN2c3ccccc3SC12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CACNA1C Q13936 1/20 0.39
▸ GSK3B P49841 2/20 0.36
▸ BCHE P06276 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ DRD4 P21917 2/20 0.34
▸ MAPT P10636 3/20 0.33
▸ TP53 P04637 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL9569380 0.91 GSK3B (0.34) CACNA1CGSK3BBCHELMNAPPARG
SCHEMBL9569373 0.89 GSK3B (0.36) GSK3BBCHELMNAMAPTTP53
SCHEMBL11011280 0.84 CACNA1C (0.35) CACNA1CGSK3BBCHELMNAHPGD
SCHEMBL9569385 0.84 MEN1 (0.44) CACNA1CBCHEDRD4MAPTTP53
SCHEMBL9569336 0.81 BACE1 (0.36) BCHEHPGDMAPTTP53KDM4E
SCHEMBL11005893 0.79 GSK3B (0.34) CACNA1CGSK3BBCHELMNAHPGD
SCHEMBL11008993 0.78 GSK3B (0.34) CACNA1CGSK3BBCHELMNAHPGD
SCHEMBL9259658 0.78 SIGMAR1 (0.31) LMNA
SCHEMBL11008882 0.75 GSK3B (0.34) CACNA1CGSK3BBCHELMNAHPGD
SCHEMBL11011669 0.75 GSK3B (0.34) CACNA1CGSK3BBCHELMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524055-A1 Imidazo(2,1-b)benzothiazole-3-acetamide derivatives, process for their preparation and their therapeutical use SYNTHELABO (FR) 1993-01-20 — — EP disclosed
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