SCHEMBL2637666

SCHEMBL2637666

O=C(NCc1ccccc1)c1c(=O)[nH]n2c(=O)cc(-c3cccc(Cl)c3)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CNR2 P34972 1/20 0.42
PIM1 P11309 2/20 0.42
ROCK2 O75116 1/20 0.42
MAPK1 P28482 1/20 0.42
MAPK10 P53779 1/20 0.42
NPC1 O15118 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 1/20 0.39
CDC7 O00311 1/20 0.39
MAP4K4 O95819 1/20 0.39
PRKACA P17612 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
SCHEMBL2637516 0.91 MEN1 (0.48) HPGDMEN1KMT2ARXFP1PIM1
SCHEMBL2637207 0.85 CNR2 (0.45) POLBMEN1KMT2ACNR2MAPK1
SCHEMBL2637493 0.82 NHERF1 (0.46) POLBHPGDMEN1KMT2ACNR2
SCHEMBL2637515 0.81 RAB9A (0.49) POLBMEN1KMT2AMAPK1NPC1
SCHEMBL2637501 0.80 NUDT1 (0.44) HPGDMEN1KMT2ACNR2NPC1
SCHEMBL2637260 0.79 CNR2 (0.50) MEN1KMT2ACNR2NPC1RAB9A
SCHEMBL2637448 0.79 NPC1 (0.46) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2637180 0.78 CGAS (0.46) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL2637249 0.77 SMN1; SMN2 (0.50) HPGDMEN1KMT2AMAPK1NPC1
SCHEMBL2637450 0.77 MEN1 (0.38) POLBTDP1MEN1KMT2ACNR2

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
EP-2438070-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP claimed
WO-2010139483-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 WO claimed
EP-2438070-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP disclosed
WO-2010139483-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 WO disclosed