SCHEMBL2439713

SCHEMBL2439713

O=C(O)Oc1cn2cc(-c3cccc(CO)c3)ccc2n1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.58
CYP2C9 P11712 1/20 0.58
KCNH2 Q12809 1/20 0.58
ACMSD Q8TDX5 1/20 0.43
EGLN1 Q9GZT9 6/20 0.43
ALDH1A3 P47895 3/20 0.40
ALDH1A1 P00352 2/20 0.40
PRKCI P41743 1/20 0.40
ALDH1A2 O94788 1/20 0.39
DHODH Q02127 1/20 0.39
FYN P06241 4/20 0.38

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
SCHEMBL2440400 0.85 NR4A2 (0.53) NR4A2CYP2C9KCNH2ACMSDEGLN1
SCHEMBL2436387 0.81 NR4A2 (0.61) NR4A2CYP2C9KCNH2ACMSDEGLN1
SCHEMBL1472422 0.79 NR4A2 (0.83) NR4A2CYP2C9KCNH2ALDH1A3ALDH1A1
SCHEMBL2088011 0.78 NR4A2 (0.57) NR4A2CYP2C9KCNH2ACMSDEGLN1
SCHEMBL3429998 0.77 NR4A2 (0.73) NR4A2CYP2C9KCNH2EGLN1ALDH1A3
SCHEMBL3774418 0.77 CYP2C9 (0.56) NR4A2CYP2C9KCNH2EGLN1ALDH1A1
SCHEMBL3368804 0.75 NR4A2 (0.60) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL6521170 0.74 NR4A2 (0.68) NR4A2CYP2C9KCNH2ALDH1A3ALDH1A1
SCHEMBL1472658 0.74 NR4A2 (0.80) NR4A2CYP2C9KCNH2ALDH1A3ALDH1A1
SCHEMBL1472288 0.74 NR4A2 (0.80) NR4A2CYP2C9KCNH2ALDH1A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2225241-B1 Derivatives of N-phenyl-imidazo-(1,2-A)-pyridine-2-carboxamides, preparation thereof and therapeutic application thereof SANOFI SA (FR) 2011-09-14 EP claimed