SCHEMBL10654258

SCHEMBL10654258

Cc1cccc2nc3c(c(N)c12)CSCC3

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 13/20 0.68
▸ GRIN1 Q05586 8/20 0.66
▸ GRIN2A Q12879 8/20 0.66
▸ BCHE P06276 8/20 0.66
▸ HRH3 Q9Y5N1 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ CACNB4 O00305 1/20 0.39
▸ CACNA1A O00555 1/20 0.39
▸ SLC22A2 O15244 1/20 0.39
▸ SLC22A1 O15245 1/20 0.39
▸ ABCC4 O15439 1/20 0.39
▸ CACNA1G O43497 1/20 0.39
▸ CACNG3 O60359 1/20 0.39
▸ CACNA1F O60840 1/20 0.39
▸ CACNA1H O95180 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ APP P05067 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ FABP1 P07148 1/20 0.39
▸ CHRM2 P08172 1/20 0.39

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
SCHEMBL10651788 0.89 ACHE (0.68) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL10653196 0.84 ACHE (0.70) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL9207530 0.83 ACHE (0.66) ACHEGRIN1GRIN2ABCHEHRH3
SCHEMBL9583623 0.81 ACHE (1.00) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL10653208 0.77 ACHE (0.58) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL4502500 0.77 ACHE (0.62) ACHEGRIN1GRIN2ABCHEHRH3
SCHEMBL9172294 0.72 ACHE (0.66) ACHEGRIN1GRIN2ABCHECHRM1
SCHEMBL10654771 0.72 ACHE (0.63) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL10654307 0.72 ACHE (0.66) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL10652480 0.72 ACHE (0.66) ACHEGRIN1GRIN2ABCHEKDM4E

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-0268871-A1 Quinoline derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-06-01 — — EP disclosed
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