SCHEMBL8556491

SCHEMBL8556491

COc1ccc(CC2NCCc3ccccc32)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.71
SLC22A1 O15245 1/20 0.71
GID4 Q8IVV7 1/20 0.62
OPRM1 P35372 2/20 0.60
OPRK1 P41145 1/20 0.60
BCHE P06276 1/20 0.53
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
PKM P14618 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL12859659 1.00 PRCP (0.71) PRCPSLC22A1GID4OPRM1OPRK1
SCHEMBL8557351 0.88 PRCP (0.65) PRCPSLC22A1GID4OPRM1OPRK1
SCHEMBL9411283 0.86 GID4 (0.59) PRCPSLC22A1GID4OPRM1OPRK1
SCHEMBL8559156 0.85 PRCP (0.66) PRCPSLC22A1GID4OPRM1OPRK1
SCHEMBL10348907 0.84 SLC22A1 (0.63) PRCPSLC22A1BCHEKDM4EMAPT
SCHEMBL8554897 0.84 SLC22A1 (0.63) PRCPSLC22A1BCHEKDM4EMAPT
SCHEMBL4024647 0.84 SLC22A1 (0.63) PRCPSLC22A1BCHEKDM4EMAPT
SCHEMBL5284097 0.84 PRCP (1.00) PRCPSLC22A1OPRM1KDM4E
SCHEMBL4160731 0.84 PRCP (1.00) PRCPSLC22A1OPRM1KDM4E
SCHEMBL5812041 0.84 PRCP (1.00) PRCPSLC22A1OPRM1KDM4E

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