SCHEMBL27701885

SCHEMBL27701885

CN(C)c1ccc(C(Cc2ccccn2)C(=O)C(Cc2ccccn2)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ PTPRA P18433 1/20 0.47
▸ GAA P10253 3/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ FDPS P14324 1/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PGR P06401 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ GRIN2D O15399 1/20 0.41
▸ GRIN3B O60391 1/20 0.41
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2A Q12879 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41

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
SCHEMBL27543486 0.81 PTPRA (0.50) PTPRAFDPSNPC1RAB9AKMT2A
SCHEMBL6559702 0.81 MAOA (0.52) MAOAMAOBPTPRAGAAALDH1A1
Iodide SCHEMBL5949407 0.80 MAOA (0.51) MAOAMAOBPTPRAGAAALDH1A1
SCHEMBL27701887 0.78 MAOA (0.49) MAOAMAOBPTPRAGAAALDH1A1
SCHEMBL7829956 0.74 PTPRA (0.65) PTPRAALDH1A1FDPSNPC1RAB9A
SCHEMBL7829954 0.74 PTPRA (0.65) PTPRAALDH1A1FDPSNPC1RAB9A
SCHEMBL5948753 0.72 RAB9A (0.66) MAOAMAOBALDH1A1NPC1RAB9A
SCHEMBL5862097 0.72 EPHX1 (0.60) PTPRAALDH1A1FDPSGRIN2DGRIN3B
SCHEMBL25214176 0.71 PTPRA (0.53) PTPRAFDPSNPC1RAB9AKMT2A
SCHEMBL27628033 0.71 PTPRA (0.55) PTPRAALDH1A1L3MBTL1FDPSRAB9A

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-100371326-C New substituted pyridine or pyridine compound, their producing process and pharmaceutical composition containing them ADIR (FR) 2008-02-27 — — CN disclosed
CN-1277192-A New substituted pyridine or pyridine compound, their producing process and pharmaceutical composition containing them ADIR (FR) 2000-12-20 — — CN disclosed
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