SCHEMBL28673955

SCHEMBL28673955

CC1(O)CCC(n2nccc2N2CCCC2c2cc(F)ccc2F)CC1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.50
▸ JAK2 O60674 6/20 0.50
▸ NTRK3 Q16288 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
SCHEMBL28072182 1.00 NTRK1 (0.50) NTRK1JAK2NTRK3
SCHEMBL19547182 0.81 NTRK1 (0.42) NTRK1JAK2NTRK3
SCHEMBL28072047 0.78 NTRK1 (0.49) NTRK1JAK2NTRK3
SCHEMBL28072045 0.78 NTRK1 (0.49) NTRK1JAK2NTRK3
SCHEMBL948530 0.78 NTRK1 (0.48) NTRK1JAK2NTRK3
SCHEMBL28072082 0.77 NTRK1 (0.50) NTRK1JAK2NTRK3
SCHEMBL15017823 0.76 NTRK1 (0.43) NTRK1JAK2NTRK3
SCHEMBL28673945 0.75 NTRK1 (0.46) NTRK1JAK2
SCHEMBL28673947 0.75 NTRK1 (0.46) NTRK1JAK2
SCHEMBL28661197 0.73 NTRK1 (0.49) 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
CN-110003214-B Substituted pyrazolo [1,5-a ] pyrimidine compounds as TRK kinase inhibitors 阵列生物制药公司 2021-12-21 — — CN disclosed
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