SCHEMBL19987910

SCHEMBL19987910

C[C@H](NC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cccc(F)c3)nc12)C(F)(F)F

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.83
NTRK1 P04629 19/20 0.83

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
SCHEMBL19987911 1.00 JAK2 (0.83) JAK2NTRK1
SCHEMBL2694126 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL4103512 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL4096265 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL2694120 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL23217003 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL2694582 0.91 JAK2 (1.00) JAK2NTRK1
SCHEMBL2696541 0.87 NTRK1 (1.00) JAK2NTRK1
SCHEMBL2696544 0.87 NTRK1 (1.00) JAK2NTRK1
SCHEMBL29794706 0.87 NTRK1 (1.00) JAK2NTRK1

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-3299372-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OFSUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS Array Biopharma, Inc. (US) 2018-03-28 EP disclosed