SCHEMBL7324955

SCHEMBL7324955

O=C(O)CNc1cccc(OS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
CA12 O43570 6/20 0.46
CA1 P00915 6/20 0.46
CA2 P00918 6/20 0.46
CA9 Q16790 6/20 0.46
CA4 P22748 3/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GPR17 Q13304 1/20 0.46
MAPT P10636 2/20 0.45
ENPP3 O14638 5/20 0.44
ENPP1 P22413 5/20 0.44
ENPP2 Q13822 2/20 0.44
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL7337064 0.83 F2 (0.46) ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2
SCHEMBL7335262 0.82 GRK2 (0.49) FAAHALDH1A1MAPK1MEN1LMNA
SCHEMBL22187323 0.81 CA2 (0.57) FAAHCA12CA1CA2CA9
SCHEMBL29620069 0.81 CA2 (0.57) FAAHCA12CA1CA2CA9
SCHEMBL22446482 0.80 MAPT (0.60) FAAHCA12CA1CA2CA9
SCHEMBL5287709 0.79 ALDH1A1 (0.59) ALDH1A1MAPTMAPK1LMNAPOLB
SCHEMBL29274193 0.79 FAAH (0.51) FAAHCA12CA1CA2CA9
SCHEMBL29673712 0.79 FAAH (0.51) FAAHCA12CA1CA2CA9
SCHEMBL3008207 0.78 FAAH (0.51) FAAHCA12CA1CA2CA9
SCHEMBL11521888 0.78 CA1 (0.60) FAAHCA1CA2ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1046710-C New 4-aminopyridines, process for preparing the same and medicaments containing the same LUOHE DIAGNOSTIC EQUIPMENT CO (DE) 1999-11-24 CN disclosed
CN-1119858-A Aminopyridines, process for their preparation and pharmaceutical compositions containing them BOEHRINGER MANNHEIM GMBH (DE) 1996-04-03 CN disclosed
EP-0687253-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME Roche Diagnostics GmbH (DE) 1995-12-20 EP disclosed
WO-1994020467-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1994-09-15 WO disclosed