SCHEMBL8760898

SCHEMBL8760898

CCC(C)(c1ccc(O)cc1)c1ccc(OC)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.53
LTA4H P09960 1/20 0.53
CALM1 P0DP23 1/20 0.50
APP P05067 2/20 0.48
ESR1 P03372 4/20 0.48
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
MAPT P10636 1/20 0.45
LMNA P02545 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.44
APEX1 P27695 1/20 0.44
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
AOC3 Q16853 1/20 0.44
CYP3A4 P08684 2/20 0.43
TYR P14679 1/20 0.43
AR P10275 1/20 0.43

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
SCHEMBL4742924 0.90 CA1 (0.50) GAAMAPTLMNAHSD17B10ALDH1A1
SCHEMBL12805064 0.87 LTA4H (0.55) ESR2LTA4HESR1MAPTLMNA
SCHEMBL68287 0.86 ESR1 (0.62) ESR2ESR1LMNAHSD17B10ALDH1A1
Methyl Alcohol SCHEMBL28148921 0.84 ESR1 (0.60) ESR2ESR1LMNAHSD17B10ALDH1A1
SCHEMBL12205178 0.84 ESR1 (0.47) ESR2LTA4HESR1LMNAHSD17B10
SCHEMBL8761121 0.84 LTA4H (0.61) ESR2LTA4HESR1LMNAHSD17B10
SCHEMBL8760915 0.83 ESR1 (0.73) ESR2LTA4HCALM1APPESR1
SCHEMBL3173618 0.83 ESR2 (0.55) ESR2LTA4HCALM1APPESR1
SCHEMBL12156568 0.83 ACHE (0.58) GAAMAPTLMNAHSD17B10ALDH1A1
SCHEMBL8761434 0.81 ESR2 (0.48) ESR2LTA4HCALM1APPESR1

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-0497465-B1 Record material APPLETON PAPER INC (US) 1997-06-04 EP disclosed
EP-0497465-A1 Record material APPLETON PAPERS INC. (US) 1992-08-05 EP disclosed