SCHEMBL28655436

SCHEMBL28655436

CC(C)c1cc(Oc2c(Br)cc(N)cc2Br)c[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 14/20 0.44
▸ THRB P10828 14/20 0.44

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
SCHEMBL30083009 0.84 THRB (0.40) THRATHRB
SCHEMBL28664588 0.83 ALDH1A1 (0.48) THRATHRB
SCHEMBL28675510 0.76 THRB (0.56) THRATHRB
SCHEMBL28650024 0.73 MCL1 (0.36) —
SCHEMBL28656735 0.73 THRB (0.55) THRATHRB
SCHEMBL7086230 0.71 THRA (0.60) THRATHRB
SCHEMBL2044734 0.71 THRA (0.71) THRATHRB
SCHEMBL29066180 0.70 THRB (0.41) THRATHRB
SCHEMBL8893247 0.70 THRB (0.57) THRATHRB
SCHEMBL29527525 0.69 THRB (0.38) THRATHRB

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-113698388-B 6-oxo-1, 6-dihydropyridine derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2022-11-22 — — CN disclosed
CN-113698388-A 6-oxo-1, 6-dihydropyridine derivatives, preparation method and application thereof in medicines 江苏恒瑞医药股份有限公司 2021-11-26 — — CN disclosed
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