SCHEMBL2637207

SCHEMBL2637207

O=C(Nc1ccccc1)c1c(=O)[nH]n2c(=O)cc(-c3cccc(Cl)c3)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.45
EGFR P00533 2/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
DHODH Q02127 1/20 0.40
ATR Q13535 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 1/20 0.40
BLM P54132 1/20 0.40
MAPK10 P53779 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
KDM4A O75164 1/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
KCNK3 O14649 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
SCHEMBL2637246 0.92 MAPK10 (0.41) CNR2EGFRRAB9ADHODHMEN1
SCHEMBL2637448 0.91 NPC1 (0.46) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL2638043 0.90 MAPK10 (0.45) NPC1RAB9ADHODHMEN1KMT2A
SCHEMBL2637493 0.88 NHERF1 (0.46) CNR2EGFRNPC1RAB9AALDH1A1
SCHEMBL2637533 0.88 MAPT (0.50) MEN1KMT2APOLBLMNAMAPT
SCHEMBL2637260 0.85 CNR2 (0.50) CNR2NPC1RAB9AALDH1A1MEN1
SCHEMBL2637666 0.85 POLB (0.43) CNR2NPC1RAB9AMEN1KMT2A
SCHEMBL2637716 0.84 KMT2A (0.47) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL2637737 0.84 NPC1 (0.43) NPC1RAB9AATRMAPT
SCHEMBL2637592 0.83 MEN1 (0.45) EGFRNPC1RAB9AALDH1A1MEN1

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