SCHEMBL7995495

SCHEMBL7995495

COc1ccc(-c2nc(C(=O)O)c(-c3ccncc3)[nH]2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 5/20 0.63
MAPK12 P53778 5/20 0.63
MAPK11 Q15759 5/20 0.63
MAPK14 Q16539 5/20 0.63
RAF1 P04049 3/20 0.63
ALOX5 P09917 4/20 0.58
GCGR P47871 2/20 0.58
MAPT P10636 4/20 0.56
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
GLA P06280 1/20 0.56
GAA P10253 1/20 0.56
HPGD P15428 1/20 0.56
CYP2C19 P33261 1/20 0.56
GFER P55789 1/20 0.56
KMT2A Q03164 1/20 0.56
CDC7 O00311 1/20 0.54
NOX1 Q9Y5S8 1/20 0.51

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
SCHEMBL15075613 1.00 MAPK13 (0.63) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL15075612 0.88 CDC7 (0.62) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7992228 0.85 PIN1 (0.68) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7977738 0.85 MAPK14 (0.56) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7992039 0.85 MAPK14 (0.56) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7989693 0.84 MAPK14 (0.54) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7992089 0.83 MAPK14 (0.62) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7977701 0.83 MAPT (0.59) MAPTKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL7989925 0.82 MAPK14 (0.62) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7992159 0.82 MAPK14 (0.68) MAPK13MAPK12MAPK11MAPK14RAF1

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
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed