SCHEMBL9853725

SCHEMBL9853725

Cc1cc(O)ccc1Oc1ccccc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.59
ALOX5 P09917 1/20 0.46
SCN9A Q15858 2/20 0.46
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
BRD4 O60885 1/20 0.40
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PELI1 Q96FA3 1/20 0.39
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BACE1 P56817 2/20 0.38
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38
BCR P11274 1/20 0.38
PTGS2 P35354 1/20 0.38
CDK4 P11802 1/20 0.38

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
SCHEMBL10931037 0.83 ALOX5 (0.53) ESR2ALOX5NCOA1NCOA3L3MBTL1
SCHEMBL8375486 0.83 MEN1 (0.47) ESR2MAPT
SCHEMBL9859720 0.81 NCOA1 (0.52) SCN9ANCOA1NCOA3L3MBTL1BRD4
SCHEMBL9842220 0.81 SCN9A (0.46) SCN9ANCOA1NCOA3L3MBTL1BRD4
SCHEMBL9298320 0.81 NCOA1 (0.58) SCN9ANCOA1NCOA3L3MBTL1BRD4
SCHEMBL5032967 0.80 CYP3A4 (0.44) ESR2
SCHEMBL5450397 0.79 ALOX5 (0.65) ESR2ALOX5KDM4EMAPTPELI1
SCHEMBL5082815 0.78 LTA4H (0.52) ESR2KDM4E
SCHEMBL23928778 0.77 ABL1 (0.54) ESR2ALOX5NCOA1NCOA3KDM4E
SCHEMBL112422 0.76 NCOA1 (0.63) SCN9ANCOA1NCOA3L3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0446722-A1 Novel hydroxylated phenoxy compounds and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP claimed
EP-0446722-A1 Novel hydroxylated phenoxy compounds and process for their preparation Bromine Compounds Ltd. (IL) 1991-09-18 EP disclosed