SCHEMBL30845580

SCHEMBL30845580

Nc1cc(Br)c(Cl)cc1OC1CC(F)(F)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AHR P35869 2/20 0.31

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
SCHEMBL24928671 1.00 POLB (0.33) POLBL3MBTL1AHR
SCHEMBL30845563 0.80 CSNK2A1 (0.42) POLBL3MBTL1AHR
SCHEMBL24928857 0.80 CSNK2A1 (0.42) POLBL3MBTL1AHR
SCHEMBL30845557 0.76 BCL6 (0.35)
SCHEMBL24928672 0.73
SCHEMBL24252902 0.72 MEN1 (0.40) L3MBTL1
SCHEMBL30451591 0.72 MEN1 (0.40) L3MBTL1
SCHEMBL24928930 0.72
SCHEMBL24928675 0.71 BRD4 (0.31)
SCHEMBL31584573 0.69 VEGFA (0.33)

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
CN-117881657-A Phenyl-sulfamoyl-benzoic acid derivatives as ERAP1 modulators 格雷沃尔夫治疗有限公司 2024-04-12 CN disclosed