SCHEMBL28259252

SCHEMBL28259252

Cc1ccc(S(=O)(=O)n2c3ccccc3c3c(N)ccc(C#N)c32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HTR6 P50406 7/20 0.45
▸ NOD1 Q9Y239 3/20 0.44
▸ NOD2 Q9HC29 2/20 0.44
▸ CXCL8 P10145 1/20 0.44
▸ AGTR1 P30556 3/20 0.43
▸ PSEN1 P49768 1/20 0.41
▸ PSEN2 P49810 1/20 0.41
▸ APH1B Q8WW43 1/20 0.41
▸ NCSTN Q92542 1/20 0.41
▸ APH1A Q96BI3 1/20 0.41
▸ PSENEN Q9NZ42 1/20 0.41
▸ ALDH3A1 P30838 2/20 0.41
▸ PCSK9 Q8NBP7 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ UBE2N P61088 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MEN1 O00255 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
SCHEMBL28267008 0.83 HTR6 (0.48) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL10375913 0.76 HTR6 (0.50) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL28259259 0.75 GBA1 (0.38) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL28446914 0.75 AGTR1 (0.46) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL16337280 0.73 MEN1 (0.43) ALDH1A1HTR6KDM4EUBE2NL3MBTL1
SCHEMBL28436494 0.73 HTR6 (0.42) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL28866612 0.73 AGTR1 (0.44) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL29357508 0.72 HTR6 (0.67) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL17297375 0.72 HTR6 (0.67) GAAALDH1A1SMN1; SMN2HTR6NOD1
SCHEMBL31487098 0.72 GAA (0.47) GAAALDH1A1SMN1; SMN2HTR6NOD1

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
CN-108947890-A A method of preparing two substitution 4- aminocarbazole class compounds 台州学院 2018-12-07 — — CN disclosed
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