SCHEMBL29618154

SCHEMBL29618154

O=Cc1cnn2ccc(N3C[C@@H](F)C[C@@H]3c3cc(F)ccc3F)nc12

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.58
JAK2 O60674 9/20 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
SCHEMBL22175157 0.85 NTRK1 (0.61) NTRK1JAK2
SCHEMBL29542542 0.85 NTRK1 (0.61) NTRK1JAK2
SCHEMBL28419867 0.85 NTRK1 (0.56) NTRK1JAK2
SCHEMBL30151383 0.84 NTRK1 (0.65) NTRK1JAK2
SCHEMBL17820710 0.84 NTRK1 (0.65) NTRK1JAK2
SCHEMBL17820882 0.84 NTRK1 (0.65) NTRK1JAK2
SCHEMBL17820785 0.83 NTRK1 (0.71) NTRK1JAK2
SCHEMBL17820786 0.83 NTRK1 (0.71) NTRK1JAK2
SCHEMBL18875082 0.83 NTRK1 (0.80) NTRK1JAK2
SCHEMBL23408740 0.83 NTRK1 (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114641476-B Preparation and application of protein receptor kinase inhibitors 上海轶诺药业有限公司 2023-05-02 CN disclosed
CN-114641476-A Preparation and application of protein receptor kinase inhibitor 上海轶诺药业有限公司 2022-06-17 CN disclosed