SCHEMBL28394159

SCHEMBL28394159

COc1cc(C2CNCCO2)ccc1Nc1ncc2cccc(-c3cccc(N)c3)c2n1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 1/20 0.55
▸ TTK P33981 3/20 0.53

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
SCHEMBL28385514 0.86 — —
SCHEMBL28420032 0.85 ALK (0.54) ALK
SCHEMBL28887740 0.84 FGFR1 (0.53) ALK
SCHEMBL28070380 0.82 TTK (0.41) TTK
SCHEMBL28070379 0.79 — —
SCHEMBL29847405 0.78 TTK (0.85) ALKTTK
SCHEMBL16514286 0.78 TTK (0.85) ALKTTK
SCHEMBL28388126 0.76 — —
SCHEMBL28387805 0.76 — —
SCHEMBL28385572 0.76 — —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109851617-B Chemical entities, compositions, and methods 润新生物公司 2022-08-16 — — CN disclosed
CN-111285813-A Chemical entities, compositions, and methods 润新生物公司 2020-06-16 — — CN disclosed
CN-105682661-B Certain chemical entities, compositions, and methods 润新生物公司 2020-03-27 — — CN disclosed
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