SCHEMBL4762264

SCHEMBL4762264

OCc1c(O)cccc1C1(c2cccc(O)c2CO)c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
PDK2 Q15119 8/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
BCL2L1 Q07817 1/20 0.38
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
OPRK1 P41145 1/20 0.36
PPIA P62937 1/20 0.36
APEX1 P27695 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
THRB P10828 2/20 0.33
NPC1 O15118 1/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL2909587 0.81 GABRA1 (0.43) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL29646285 0.78 ESR1 (0.50) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL29482233 0.78 ESR1 (0.50) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL382439 0.78 ESR1 (0.50) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL2913120 0.77 GCGR (0.43) ESR1ESR2ALDH1A1HPGDHSD17B10
SCHEMBL4792150 0.76 ALDH1A1 (0.46) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL29616923 0.76 ALDH1A1 (0.46) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL23214341 0.76 ESR1 (0.48) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL6297787 0.75 PDK2 (0.58) ESR1ESR2PDK2ALDH1A1HPGD
SCHEMBL30749155 0.75 PDK2 (0.58) ESR1ESR2PDK2ALDH1A1HPGD

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
JP-2008273844-A NEW FLUORENE COMPOUND HAVING PHENOLIC HYDROXY GROUP AND METHYLOL GROUP AND METHOD FOR PRODUCING THE SAME OSAKA GAS CO LTD 2008-11-13 JP disclosed