SCHEMBL28612431

SCHEMBL28612431

COc1ccc(C2CC(=O)c3cc(Cl)ccc3N2)cc1.NNC(=O)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 9/20 0.45
FPR1 P21462 10/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GRIK1 P39086 1/20 0.39

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
SCHEMBL28604211 0.92 FPR2 (0.46) FPR2FPR1MEN1KMT2AGRIK1
SCHEMBL28599108 0.91 FPR1 (0.47) FPR2FPR1MEN1KMT2AGRIK1
SCHEMBL28608358 0.91 FPR1 (0.47) FPR2FPR1MEN1KMT2AGRIK1
SCHEMBL28608487 0.90 ALDH1A1 (0.38) FPR2FPR1MEN1KMT2A
SCHEMBL28611051 0.88 MAPT (0.42) FPR2FPR1GRIK1
SCHEMBL28599093 0.88 LIG1 (0.39) FPR2FPR1MEN1KMT2AGRIK1
SCHEMBL28617934 0.84 ALDH1A1 (0.39) FPR2FPR1MEN1KMT2A
SCHEMBL28603927 0.84 MAOB (0.43)
SCHEMBL28617961 0.84 ALDH1A1 (0.40) FPR2FPR1MEN1KMT2A
SCHEMBL28606032 0.82 GRIK1 (0.41) FPR2FPR1MEN1KMT2AGRIK1

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-108558756-B 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2021-08-03 CN claimed