SCHEMBL8726752

SCHEMBL8726752

Oc1cccc(-c2cccc(O)c2-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
HPGD P15428 4/20 0.61
HSD17B10 Q99714 4/20 0.61
BCL2L1 Q07817 1/20 0.61
BACE1 P56817 3/20 0.52
MAOA P21397 3/20 0.50
MAPT P10636 4/20 0.48
ALOX15 P16050 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 1/20 0.48
MAOB P27338 1/20 0.48
HTT P42858 1/20 0.48
HNF4A P41235 1/20 0.47
HDAC4 P56524 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46

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
SCHEMBL7853754 0.95 HPGD (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL18150 0.93 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL30028001 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL28127028 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Hydrogen Sulfide SCHEMBL27801479 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL23329593 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Hydrochloric Acid SCHEMBL29234311 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL28918851 0.91 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL355552 0.87 ALDH1A1 (0.55) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL675483 0.87 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2067365-A None JP disclosed
EP-0857758-A1 Adhesive resin compositions, laminates, production method thereof and oriented films Mitsubishi Chemical Corporation (JP) 1998-08-12 EP disclosed
JP-H0267365-A HEAT-RESISTANT RESIN COMPOSITION SEKISUI CHEM CO LTD 1990-03-07 JP disclosed