SCHEMBL5071504

SCHEMBL5071504

CN(C(=O)Cc1ccon1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
POLQ O75417 4/20 0.47
KMT2A Q03164 3/20 0.43
NPC1 O15118 1/20 0.43
PKM P14618 1/20 0.43
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 2/20 0.40
MEN1 O00255 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 2/20 0.39
HPGD P15428 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
SCHEMBL5068890 0.80 POLQ (0.48) LMNATP53MAPTPOLQKMT2A
SCHEMBL8263373 0.73 ALDH1A1 (0.58) LMNAPOLQKMT2ANPC1ROCK2
SCHEMBL7451732 0.73 NPC1 (0.36) LMNANPC1PKMALDH1A1POLB
SCHEMBL11438169 0.73 ROCK2 (0.47) LMNATP53MAPTPOLQKMT2A
SCHEMBL1331254 0.73
SCHEMBL20899861 0.72 POLQ (0.46) LMNATP53MAPTPOLQKMT2A
SCHEMBL98627 0.71 KMT2A (0.54) POLQKMT2AALDH1A1POLBMEN1
SCHEMBL1760632 0.70 KMT2A (0.58) LMNAPOLQKMT2ANPC1ALDH1A1
SCHEMBL5601309 0.69 KMT2A (0.56) POLQKMT2AALDH1A1POLBMEN1
SCHEMBL9887 0.69 KMT2A (0.56) TP53POLQKMT2ANPC1ALDH1A1

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
EP-1896394-A1 SUBSTITUTED ENAMINONES AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS The Regents of the University of California (US) 2008-03-12 EP disclosed
WO-2006138510-A1 SUBSTITUTED ENAMINONES AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-12-28 WO disclosed