SCHEMBL7302053

SCHEMBL7302053

CC(=O)Nc1ccc(N2CCC(=O)CC2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.73
KMT2A Q03164 5/20 0.73
MEN1 O00255 4/20 0.73
ALDH1A1 P00352 2/20 0.73
KDM4E B2RXH2 1/20 0.73
GAA P10253 1/20 0.73
GFER P55789 2/20 0.71
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
CYP2C19 P33261 1/20 0.71
CHRNA10 Q9GZZ6 1/20 0.57
CHRNA9 Q9UGM1 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.55
POLB P06746 2/20 0.53
EPHX1 P07099 1/20 0.51
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.50
SCN2A Q99250 1/20 0.50

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
SCHEMBL6073863 0.87 GFER (0.77) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL975489 0.84 MAPT (1.00) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL27598434 0.83 MAPT (0.50) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL6689700 0.83 GFER (1.00) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9382745 0.81 MAPT (0.75) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL429085 0.81 MAPT (0.75) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL13912 0.81 KMT2A (0.75) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL6075470 0.80 SMN1; SMN2 (0.74) MAPTALDH1A1KDM4EGAAL3MBTL1
SCHEMBL30620451 0.80 MAPT (1.00) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL532005 0.80 KMT2A (0.73) MAPTKMT2AMEN1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481299-B1 N-phenyl-piperidyl-4-amines and drugs containing them BASF AG (DE) 1994-07-20 EP disclosed
US-5260318-A Phenylpiperidylamines and drugs containing them BASF AKTIENGESELLSCHAFT (DE) 1993-11-09 US disclosed
EP-0481299-A2 N-phenyl-piperidyl-4-amines and drugs containing them BASF Aktiengesellschaft (DE) 1992-04-22 EP disclosed