SCHEMBL19547437

SCHEMBL19547437

CC1(C)OCC(COc2ccc(F)cc2[C@H]2CCCN2c2ccn3ncc(OC(=O)NC4CC4)c3n2)O1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.83
▸ JAK2 O60674 18/20 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
SCHEMBL19547349 0.91 NTRK1 (0.83) NTRK1JAK2
SCHEMBL951822 0.91 NTRK1 (1.00) NTRK1JAK2
SCHEMBL19547400 0.88 NTRK1 (0.82) NTRK1JAK2
SCHEMBL946904 0.88 JAK2 (0.89) NTRK1JAK2
SCHEMBL2693914 0.86 NTRK1 (1.00) NTRK1JAK2
SCHEMBL19547348 0.85 NTRK1 (0.81) NTRK1JAK2
SCHEMBL1082491 0.85 NTRK1 (0.84) NTRK1JAK2
SCHEMBL19547549 0.84 NTRK1 (0.66) NTRK1JAK2
SCHEMBL19547347 0.82 NTRK1 (0.81) NTRK1JAK2
SCHEMBL19547500 0.82 NTRK1 (0.74) 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-2451812-B1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2017-11-08 — — EP claimed
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