SCHEMBL31301049

SCHEMBL31301049

Cc1cc(-c2ccc(Br)cn2)nc2ccc(Oc3c(Cl)cc(-n4ncc(=O)[nH]c4=O)cc3Cl)cc12

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 20/20 0.47
THRA P10827 4/20 0.47

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
SCHEMBL31301053 0.92 THRB (0.49) THRBTHRA
SCHEMBL31301057 0.90 THRB (0.55) THRBTHRA
SCHEMBL25293966 0.86 THRB (0.43) THRBTHRA
SCHEMBL30460741 0.86 THRB (0.43) THRBTHRA
SCHEMBL31301029 0.84 THRB (0.45) THRBTHRA
SCHEMBL25768404 0.84 THRB (0.45) THRBTHRA
SCHEMBL30511663 0.79 METAP1 (0.42)
SCHEMBL25245194 0.78 THRB (0.44) THRBTHRA
SCHEMBL30460685 0.78 THRB (0.44) THRBTHRA
SCHEMBL25290274 0.78 THRB (0.44) THRBTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4458820-A1 CLASS OF QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2024-11-06 EP disclosed