SCHEMBL29904389

SCHEMBL29904389

CC(C)(C)n1nc(-c2ccc3cc(C(=O)Nc4nncs4)[nH]c3c2)c2c(N)ncnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 20/20 1.00
▸ RET P07949 18/20 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
SCHEMBL21958113 1.00 KDR (1.00) KDRRET
SCHEMBL29904388 0.88 KDR (1.00) KDRRET
SCHEMBL21958116 0.88 KDR (1.00) KDRRET
SCHEMBL21958159 0.88 KDR (1.00) KDRRET
SCHEMBL29677907 0.88 KDR (1.00) KDRRET
SCHEMBL20535543 0.88 KDR (1.00) KDRRET
SCHEMBL20534935 0.88 KDR (1.00) KDRRET
SCHEMBL29904390 0.87 KDR (1.00) KDRRET
SCHEMBL21958132 0.87 KDR (1.00) KDRRET
SCHEMBL20535290 0.86 KDR (0.82) KDRRET

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 5 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
EP-4105219-A1 PYRAZOLOPYRIMIDINE COMPOUNDS USEFUL AS RET INHIBITORS Cancer Research Technology Limited (GB) 2022-12-21 — — EP 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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