SCHEMBL6916752

SCHEMBL6916752

Oc1cc(O)c(Cc2ccccc2)cc1Br.Oc1ccc(Cc2ccccc2)c(O)c1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.75
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 1/20 0.53
BCL2 P10415 1/20 0.49
BCL2L1 Q07817 1/20 0.49
KEAP1 Q14145 1/20 0.46
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HSD17B3 P37058 1/20 0.43
TYR P14679 1/20 0.43
HSP90AA1 P07900 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
SCHEMBL876094 0.90 BCL2 (0.59) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL29655585 0.87 ALOX5 (1.00) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL29655583 0.87 ALOX5 (1.00) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL68292 0.87 ALOX5 (1.00) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL27743753 0.80 ALOX5 (0.67) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL7692955 0.78 MEN1 (0.87) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL7054107 0.77 BCL2 (0.71) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL4055779 0.77 MAPT (0.81) ALOX5MEN1KMT2AMAPTKEAP1
SCHEMBL8961478 0.77 MEN1 (0.72) ALOX5MEN1KMT2AMAPTBCL2
SCHEMBL875665 0.76 MAPT (0.68) ALOX5MEN1KMT2AMAPTKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004039310-A2 TEAT DIP COMPOSITION CONTAINING PHENOL AND PHENATE SPORICIDIN COMPANY (US) 2004-05-13 WO disclosed
EP-1248830-A1 ANTIMICROBIAL COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-10-16 EP disclosed
WO-2001053444-A1 ANTIMICROBIAL COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-07-26 WO disclosed
WO-2001053443-A1 ANTIMICROBIAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-07-26 WO disclosed