SCHEMBL7953519

SCHEMBL7953519

Cc1ccc(-n2c(=O)c3c[nH]c4cc(Cl)ccc4n-3c2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TP53 P04637 4/20 0.40
POLB P06746 3/20 0.39
DUSP3 P51452 1/20 0.39
PTPN5 P54829 1/20 0.39
PTPN11 Q06124 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPD P32754 2/20 0.37
PLK4 O00444 1/20 0.36
AURKA O14965 1/20 0.36
RPS6KA4 O75676 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
GSK3B P49841 1/20 0.36
MARK2 Q7KZI7 1/20 0.36
BRSK1 Q8TDC3 1/20 0.36
AURKB Q96GD4 1/20 0.36

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
SCHEMBL9735988 0.90 POLB (0.39) LMNAKMT2AMEN1L3MBTL1TP53
SCHEMBL7941792 0.82 SMN1; SMN2 (0.43) LMNAKMT2ATP53POLBALDH1A1
SCHEMBL7951665 0.79 LMNA (0.40) LMNAKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7949052 0.78 KMT2A (0.44) KMT2AMEN1TP53POLBALDH1A1
SCHEMBL7948011 0.74 TP53 (0.38) LMNAKMT2AL3MBTL1TP53ALDH1A1
SCHEMBL7949177 0.74 KDM4E (0.51) LMNAKMT2AMEN1L3MBTL1TP53
SCHEMBL7941798 0.70 PGR (0.46) LMNAKMT2AMEN1L3MBTL1KDM4E
SCHEMBL7949077 0.69 MAPT (0.42) LMNAKMT2AMEN1TP53POLB
SCHEMBL7949731 0.69 HSP90AA1 (0.41) LMNAKMT2AMEN1L3MBTL1POLB
SCHEMBL7941785 0.69 LMNA (0.39) LMNAKMT2AL3MBTL1POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6268496-B1 GAMMA-AMINOBUTYRIC ACID RECEPTOR LIGANDS NEUROGEN CORPORATION 2001-07-31 US claimed
EP-0555391-A1 CERTAIN IMIDAZOQUINOXALINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1993-08-18 EP claimed
WO-1992007853-A1 CERTAIN IMIDAZOQUINOXALINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1992-05-14 WO claimed
US-6268496-B1 GAMMA-AMINOBUTYRIC ACID RECEPTOR LIGANDS NEUROGEN CORPORATION 2001-07-31 US disclosed
US-5744602-A PSYCHOLOGICAL DISORDERS, ANTICONVULSANTS NEUROGEN CORPORATION (US) 1998-04-28 US disclosed