SCHEMBL2569989

SCHEMBL2569989

COc1cncc(CC(C=O)C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.40
CYP11B1 P15538 4/20 0.39
CYP11B2 P19099 4/20 0.39
GGPS1 O95749 2/20 0.37
KCNH2 Q12809 1/20 0.37
MKNK2 Q9HBH9 2/20 0.37
MKNK1 Q9BUB5 1/20 0.37
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
VNN1 O95497 1/20 0.34
ROCK2 O75116 1/20 0.34
MAP4K4 O95819 1/20 0.34
PRKACA P17612 1/20 0.34
ROCK1 Q13464 1/20 0.34
DYRK1A Q13627 1/20 0.34

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
SCHEMBL15258783 0.87 CYP11B1 (0.36) CYP11B1CYP11B2GGPS1KCNH2MKNK2
SCHEMBL22444712 0.79 TPH1 (0.46) MEN1KMT2APPARG
Hydrochloric Acid SCHEMBL20502943 0.78 TPH1 (0.47) MEN1KMT2APPARG
Hydrochloric Acid SCHEMBL20502942 0.78 TPH1 (0.47) MEN1KMT2APPARG
SCHEMBL29633710 0.77 CYP11B1 (0.44) LDHACYP11B1CYP11B2KCNH2KDM1A
SCHEMBL4412334 0.76 HCAR2 (0.39) VNN1
Formamide SCHEMBL28048194 0.75 MKNK2 (0.40) CYP11B1CYP11B2GGPS1KCNH2MKNK2
SCHEMBL9900895 0.75 LDHA (0.36) LDHAPPARGPPARAMAP4K4
SCHEMBL3967034 0.73 CYP11B1 (0.43) CYP11B1CYP11B2KCNH2MKNK2MKNK1
SCHEMBL15267193 0.73 CYP11B1 (0.43) CYP11B1CYP11B2GGPS1KCNH2MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382205-B1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI SA (FR) 2014-04-23 EP disclosed
EP-2382205-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI (FR) 2011-11-02 EP disclosed
WO-2010076524-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI-AVENTIS (FR) 2010-07-08 WO disclosed