SCHEMBL11078452

SCHEMBL11078452

COc1cc(Br)c(O)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
PTGS2 P35354 1/20 0.50
EP300 Q09472 2/20 0.49
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 1/20 0.44
ALOX15 P16050 2/20 0.43
ALOX12 P18054 2/20 0.43
ERN1 O75460 1/20 0.42
TP53 P04637 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
TSHR P16473 1/20 0.42
IDO1 P14902 1/20 0.41
NQO2 P16083 1/20 0.41
HPGD P15428 3/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL28795609 0.85 ALOX5 (0.50) ALOX5PTGS2EP300KMT2AALDH1A1
SCHEMBL9627412 0.82 EP300 (0.48) EP300KMT2AALDH1A1MAPTMEN1
SCHEMBL7622167 0.80 EP300 (0.56) PTGS2EP300KMT2AALDH1A1MAPT
SCHEMBL5172040 0.80 EP300 (0.47) EP300KMT2AALDH1A1MAPTMEN1
SCHEMBL23087367 0.79 HPGD (0.48) ALOX5PTGS2EP300KMT2AALDH1A1
SCHEMBL30678878 0.78 SMN1; SMN2 (0.54) EP300ALDH1A1MAPTPOLBCA1
SCHEMBL3747262 0.78 SMN1; SMN2 (0.54) EP300ALDH1A1MAPTPOLBCA1
SCHEMBL13714134 0.78 IDO1 (0.42) EP300MAPTPOLBCA1CA2
SCHEMBL6572943 0.78 HTT (0.59) ALOX5PTGS2EP300ALDH1A1MAPT
SCHEMBL11075329 0.77 EP300 (0.44) EP300KMT2AALDH1A1MAPTMEN1

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-4460681-A COLOR FORMING LAYERS, AND SOLVENT SOLUBLE BARRIE LAYERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-07-17 US disclosed