SCHEMBL28259259

SCHEMBL28259259

Cc1ccc(S(=O)(=O)n2c3ccccc3c3c(N)c(C#N)cc(-c4cccs4)c32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 5/20 0.38
▸ GAA P10253 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ HTR6 P50406 5/20 0.38
▸ PSEN1 P49768 1/20 0.37
▸ PSEN2 P49810 1/20 0.37
▸ APH1B Q8WW43 1/20 0.37
▸ NCSTN Q92542 1/20 0.37
▸ APH1A Q96BI3 1/20 0.37
▸ PSENEN Q9NZ42 1/20 0.37
▸ CXCL8 P10145 1/20 0.37
▸ NOD2 Q9HC29 1/20 0.37
▸ NOD1 Q9Y239 1/20 0.37
▸ AGTR1 P30556 2/20 0.36
▸ PCSK9 Q8NBP7 1/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ PIK3CG P48736 1/20 0.35

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
SCHEMBL28260975 0.83 PIK3CD (0.42) GBA1GAAALDH1A1SMN1; SMN2HTR6
SCHEMBL28267008 0.76 HTR6 (0.48) GAAALDH1A1SMN1; SMN2HTR6PSEN1
SCHEMBL23380249 0.76 AGTR1 (0.43) GBA1GAAALDH1A1SMN1; SMN2HTR6
SCHEMBL28259252 0.75 GAA (0.46) GAAALDH1A1SMN1; SMN2HTR6PSEN1
SCHEMBL23380250 0.71 AGTR1 (0.42) GBA1GAAALDH1A1SMN1; SMN2HTR6
SCHEMBL28436494 0.71 HTR6 (0.42) GAAALDH1A1SMN1; SMN2HTR6PSEN1
SCHEMBL23380749 0.71 AGTR1 (0.41) GBA1GAAALDH1A1SMN1; SMN2HTR6
SCHEMBL28446914 0.71 AGTR1 (0.46) GAAALDH1A1SMN1; SMN2HTR6PSEN1
SCHEMBL28259608 0.70 AGTR1 (0.44) GAAALDH1A1SMN1; SMN2HTR6PSEN1
SCHEMBL10375913 0.70 HTR6 (0.50) GAAALDH1A1SMN1; SMN2HTR6PSEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108947890-B Method for preparing disubstituted 4-aminocarbazole compound 台州学院 2020-08-04 — — CN disclosed
CN-108947890-A A method of preparing two substitution 4- aminocarbazole class compounds 台州学院 2018-12-07 — — CN disclosed
Send feedback