SCHEMBL8354447

SCHEMBL8354447

CCCc1ccc(C(=O)OC)c(Nc2cc(C(C)(C)C)nn2-c2ccccc2C)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.50
MAPK13 O15264 5/20 0.50
MAPK12 P53778 5/20 0.50
MAPK11 Q15759 5/20 0.50
NTRK1 P04629 1/20 0.43
BRAF P15056 2/20 0.39
HPGD P15428 1/20 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
SCHEMBL5008408 0.94 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5005410 0.87 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5005441 0.86 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5010746 0.85 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5012010 0.85 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5007786 0.80 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5011970 0.79 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5010626 0.78 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL3307066 0.76 GFER (0.46) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5010659 0.75 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11NTRK1

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
WO-2004050651-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2004-06-17 WO disclosed