SCHEMBL2637787

SCHEMBL2637787

CCOC(=O)c1c(=O)[nH]n2c(=O)cc(C3CCCC3)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLAT P00750 5/20 0.42
ALDH1A1 P00352 5/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 3/20 0.40
PIK3CB P42338 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL2637483 0.95 PLAT (0.43) PLATALDH1A1MEN1MAPTKMT2A
SCHEMBL2637577 0.74 MAPT (0.53) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL2638131 0.73 ALDH1A1 (0.43) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL2637640 0.72 PDE3B (0.46) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL2637603 0.70 ALOX5 (0.48) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL3411734 0.68 LMNA (0.58) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL2637689 0.67 CCNA2 (0.42) PLATALDH1A1MEN1KMT2APIK3CB
SCHEMBL23683888 0.67 KDM4E (0.64) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL3407318 0.66 ALDH1A1 (0.53) ALDH1A1MEN1MAPTKMT2AGAA
SCHEMBL20077971 0.66 LMNA (0.43) ALDH1A1MEN1MAPTKMT2AGAA

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-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