SCHEMBL10458946

SCHEMBL10458946

CC1(C)CON(Cc2ccc(N3C(=O)c4ccccc4C3=O)cc2Br)C1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.61
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
PGR P06401 3/20 0.35
NR1H3 Q13133 3/20 0.35
NR1H2 P55055 1/20 0.35
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
SCN2A Q99250 4/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
PIM3 Q86V86 1/20 0.33
HIPK4 Q8NE63 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM4 Q14833 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL10460205 0.87 BRD4 (0.78) BRD4MEN1KMT2APGRNR1H3
SCHEMBL10458975 0.87 BRD4 (0.61) BRD4MEN1KMT2APGRNR1H3
SCHEMBL10460975 0.87 BRD4 (0.61) BRD4MEN1KMT2APGRNR1H3
SCHEMBL10460153 0.80 BRD4 (0.71) BRD4MEN1KMT2APGRGRM1
SCHEMBL7797402 0.79 BRD4 (0.43) BRD4MEN1KMT2ARAB9ACA12
SCHEMBL10460651 0.79 BRD4 (0.73) BRD4MEN1KMT2ACA12CA1
SCHEMBL25072255 0.78 BRD4 (0.43) BRD4MEN1KMT2ARAB9APOLB
SCHEMBL10460606 0.78 BRD4 (0.72) BRD4PGRGRM1GRM4
SCHEMBL10460154 0.78 BRD4 (0.72) BRD4MEN1KMT2APGRGAA
SCHEMBL10458955 0.78 BRD4 (0.68) BRD4MEN1KMT2APGRGRM1

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
US-4892578-A Phenylmethyl-4,4-dimethyl-3-isoxazolidinone plant regulators FMC CORPORATION (US) 1990-01-09 US disclosed