SCHEMBL29904396

SCHEMBL29904396

CC(C)(C)n1nc(-c2ccc3cc(C(=O)NC4CC4)[nH]c3c2)c2c(N)ncnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 20/20 1.00
▸ KDR P35968 19/20 1.00

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
SCHEMBL21958121 1.00 RET (1.00) RETKDR
SCHEMBL29904403 0.97 RET (1.00) RETKDR
SCHEMBL21958147 0.97 RET (1.00) RETKDR
SCHEMBL20535287 0.89 RET (1.00) RETKDR
SCHEMBL21958118 0.88 RET (1.00) RETKDR
SCHEMBL29677915 0.88 RET (1.00) RETKDR
SCHEMBL20535371 0.87 RET (1.00) RETKDR
SCHEMBL20534666 0.87 RET (1.00) RETKDR
SCHEMBL20534933 0.86 KDR (1.00) RETKDR
SCHEMBL20535535 0.86 RET (1.00) RETKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110506043-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2022-11-01 — — CN claimed
CN-115785100-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2025-01-07 — — CN disclosed
CN-115785100-A Compounds useful as RET inhibitors 癌症研究科技有限公司 2023-03-14 — — CN disclosed
CN-110506043-B Compounds useful as RET inhibitors 癌症研究科技有限公司 2022-11-01 — — CN disclosed
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