SCHEMBL2572107

SCHEMBL2572107

Nc1ccc(NC(CO)c2ccc(F)cc2)nc1Nc1cc(C2CC2)[nH]n1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 18/20 0.66
JAK2 O60674 1/20 0.49
JAK3 P52333 1/20 0.49

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
SCHEMBL2572103 1.00 NTRK1 (0.66) NTRK1JAK2JAK3
SCHEMBL27856027 0.93 NTRK1 (0.64) NTRK1JAK2JAK3
SCHEMBL2565272 0.93 NTRK1 (0.64) NTRK1JAK2JAK3
SCHEMBL4072344 0.87 NTRK1 (0.80) NTRK1
SCHEMBL27856020 0.86 NTRK1 (0.71) NTRK1JAK2JAK3
SCHEMBL2566970 0.86 NTRK1 (0.71) NTRK1JAK2JAK3
SCHEMBL2634646 0.85 NTRK1 (0.72) NTRK1JAK2JAK3
SCHEMBL4694176 0.85 NTRK1 (0.77) NTRK1JAK2JAK3
SCHEMBL2567488 0.85 NTRK1 (0.77) NTRK1JAK2JAK3
SCHEMBL22535653 0.85 NTRK1 (0.63) NTRK1JAK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101155800-B Pyrazolylaminopyridine derivatives useful as kinase inhibitors ASTRAZENECA AB 2012-05-23 CN disclosed
EP-2383268-A1 Pyrazolylaminopyridine derivatives useful as kinase inhibitors AstraZeneca AB (SE) 2011-11-02 EP disclosed