SCHEMBL19987903

SCHEMBL19987903

CCCOc1cc(F)cc([C@H]2CCCN2c2ccn3ncc(C(=O)NC4CC4)c3n2)c1

nearest known ligand 0.89

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.89
▸ JAK2 O60674 16/20 0.89

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
SCHEMBL2694949 0.94 NTRK1 (1.00) NTRK1JAK2
SCHEMBL2694945 0.94 NTRK1 (1.00) NTRK1JAK2
SCHEMBL2692944 0.89 NTRK1 (1.00) NTRK1JAK2
SCHEMBL2692949 0.89 NTRK1 (1.00) NTRK1JAK2
SCHEMBL30010121 0.89 NTRK1 (1.00) NTRK1JAK2
SCHEMBL948625 0.88 NTRK1 (1.00) NTRK1JAK2
SCHEMBL30009477 0.88 NTRK1 (1.00) NTRK1JAK2
SCHEMBL932823 0.85 NTRK1 (0.88) NTRK1JAK2
SCHEMBL932821 0.85 NTRK1 (0.88) NTRK1JAK2
SCHEMBL30009510 0.85 NTRK1 (1.00) NTRK1JAK2

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
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