SCHEMBL8554309

SCHEMBL8554309

COc1ccc(OC)c(Cc2nccc3ccccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 7/20 0.56
PDE3B Q13370 3/20 0.52
PDE3A Q14432 3/20 0.52
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 4/20 0.47
LMNA P02545 3/20 0.47
MAPK1 P28482 3/20 0.47
USP2 O75604 2/20 0.47
CYP3A4 P08684 2/20 0.47
HIF1A Q16665 2/20 0.47
PDE2A O00408 1/20 0.47
ABCC4 O15439 1/20 0.47
PDE5A O76074 1/20 0.47
ABCB11 O95342 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL8559774 0.85 RAB9A (0.56) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL1446506 0.83 GAA (0.53) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL23457928 0.83 RAB9A (0.50) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL10867414 0.80 RAB9A (0.58) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL1445588 0.79 PDE10A (0.66) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL1445580 0.78 PDE10A (0.51) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL4429531 0.78 PDE10A (0.75) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL1445418 0.78 POLB (0.43) PDE10APDE3BPDE3ARAB9ASMN1; SMN2
SCHEMBL23459855 0.78 MTNR1A (0.51) PDE10APDE3BPDE3ARAB9A
SCHEMBL8554954 0.78 PDE10A (0.53) PDE10APDE3BPDE3ARAB9ASMN1; SMN2

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-0617022-B1 6,7, dialkoxy-3,4-dihydroisoquinolin-8-ol, process for preparation thereof and process for preparation of 6,7-dialkoxy-1,2,3,4-tetrahydroisoquinolin-8-ol using the compound BANYU PHARMA CO LTD (JP) 1998-02-11 EP disclosed
EP-0617022-A1 6,7, dialkoxy-3,4-dihydroisoquinolin-8-ol, process for preparation thereof and process for preparation of 6,7-dialkoxy-1,2,3,4-tetrahydroisoquinolin-8-ol using the compound BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-09-28 EP disclosed