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Sugi Predict / Compounds / SCHEMBL21431823

SCHEMBL21431823

SCHEMBL21431823

COc1cc2nccc(Oc3ccc(Nc4nn(C)cc4C(=O)Nc4ccc(C)cc4)cc3F)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 20/20 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
SCHEMBL30216594 1.00 AXL (1.00) AXL
SCHEMBL30216604 0.94 AXL (1.00) AXL
SCHEMBL21408211 0.94 AXL (1.00) AXL
SCHEMBL30216584 0.94 AXL (1.00) AXL
SCHEMBL21408233 0.94 AXL (1.00) AXL
SCHEMBL30216582 0.94 AXL (1.00) AXL
SCHEMBL21432107 0.94 AXL (1.00) AXL
SCHEMBL21432072 0.93 AXL (0.88) AXL
SCHEMBL30216605 0.93 AXL (0.88) AXL
SCHEMBL21431949 0.92 AXL (0.87) AXL

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-112313213-B 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2023-01-31 — — CN claimed
CN-112313213-A 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2021-02-02 — — CN claimed
CN-112313213-B 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2023-01-31 — — CN disclosed
CN-112313213-A 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2021-02-02 — — CN disclosed
WO-2019184918-A1 3-AMINOPYRAZOLE COMPOUND AND APPLICATION THEREOF 暨南大学 2019-10-03 — — WO disclosed
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