SCHEMBL29589859

SCHEMBL29589859

COCc1ccc(NC(=O)c2cn(C(C)(C)C3CC3)c3ncnc(N)c23)cc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 20/20 1.00
▸ LCK P06239 1/20 0.57
▸ SRC P12931 1/20 0.57

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
SCHEMBL19763854 1.00 RET (1.00) RETLCKSRC
SCHEMBL19763834 0.90 RET (1.00) RET
SCHEMBL29588858 0.90 RET (1.00) RET
SCHEMBL19763845 0.88 RET (1.00) RETLCKSRC
SCHEMBL29589250 0.88 RET (1.00) RETLCKSRC
SCHEMBL22369946 0.88 RET (0.89) RET
SCHEMBL19763853 0.87 RET (1.00) RET
SCHEMBL19763842 0.83 RET (1.00) RETLCKSRC
SCHEMBL22369951 0.82 RET (0.85) RET
SCHEMBL29588856 0.81 RET (1.00) RET

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-108697714-B Fused pyrimidine compound or salt thereof 大鹏药品工业株式会社 2022-04-26 — — CN claimed
CN-108697714-B Fused pyrimidine compound or salt thereof 大鹏药品工业株式会社 2022-04-26 — — CN disclosed
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