SCHEMBL6545185

SCHEMBL6545185

NS(=O)(=O)C(c1ccc2[nH]nc(-c3cccc(F)c3)c2c1)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 13/20 0.51
TTK P33981 6/20 0.46
MAP2K7 O14733 4/20 0.43
NTRK1 P04629 1/20 0.43
MAPK8 P45983 1/20 0.41

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
SCHEMBL6545253 0.74 MAP2K4 (0.52) MAP2K4TTKMAP2K7NTRK1MAPK8
SCHEMBL14516332 0.73 AURKA (0.59) MAP2K4TTKNTRK1
SCHEMBL2862911 0.70 MAPK1 (0.53) MAP2K4TTKMAP2K7NTRK1
SCHEMBL5801740 0.70 MAP2K4 (0.65) MAP2K4TTKMAP2K7NTRK1MAPK8
SCHEMBL2869839 0.70 MAP2K4 (0.61) MAP2K4TTKMAP2K7NTRK1
SCHEMBL6759015 0.70 TAAR1 (0.54) MAP2K4TTKNTRK1
Ethylene SCHEMBL27536148 0.69 MAP2K4 (0.65) MAP2K4TTKNTRK1
SCHEMBL2860957 0.69 AURKA (0.66) MAP2K4TTKMAP2K7
SCHEMBL2858476 0.69 MAP2K4 (0.68) MAP2K4TTKNTRK1
SCHEMBL22819388 0.68 MAP2K4 (1.00) MAP2K4TTKMAP2K7

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-1380576-A1 NOVEL 1H-INDAZOLE COMPOUND Eisai Co., Ltd. (JP) 2004-01-14 EP disclosed