SCHEMBL28849935

SCHEMBL28849935

O=C(Nc1ccc(Oc2cc(NC(=O)C3CC3)ncn2)cc1)Nc1ccc(C(=O)O)c(C(F)(F)F)c1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 20/20 0.81
▸ BRAF P15056 5/20 0.80

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
SCHEMBL28849906 0.93 KDR (0.79) KDRBRAF
SCHEMBL30513594 0.90 KDR (1.00) KDRBRAF
SCHEMBL16907602 0.90 KDR (1.00) KDRBRAF
SCHEMBL29827613 0.89 KDR (0.85) KDRBRAF
SCHEMBL22541638 0.89 KDR (0.85) KDRBRAF
SCHEMBL29827725 0.89 KDR (1.00) KDRBRAF
SCHEMBL16907486 0.89 KDR (1.00) KDRBRAF
SCHEMBL28849922 0.87 KDR (0.79) KDRBRAF
SCHEMBL30513595 0.87 KDR (0.79) KDRBRAF
SCHEMBL28849902 0.85 KDR (0.67) KDRBRAF

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-115108998-B Compounds for resisting hepatitis B virus and application thereof 重庆医科大学 2023-06-30 — — CN disclosed
CN-115108998-A Compound for resisting hepatitis B virus and application thereof 重庆医科大学 2022-09-27 — — CN disclosed
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