SCHEMBL8556218

SCHEMBL8556218

c1cncc(CC2NCCc3ccccc32)c1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.71
SLC22A1 O15245 1/20 0.71
KDM4C Q9H3R0 1/20 0.49
ADRB2 P07550 1/20 0.49
RECQL P46063 1/20 0.48
GSK3B P49841 1/20 0.45
OPRM1 P35372 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
KDM1A O60341 1/20 0.42

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
SCHEMBL29768314 0.84 PRCP (1.00) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
SCHEMBL5812041 0.84 PRCP (1.00) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
SCHEMBL4160731 0.84 PRCP (1.00) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
SCHEMBL5284097 0.84 PRCP (1.00) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
Water SCHEMBL28203568 0.82 PRCP (0.97) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
Hydrochloric Acid SCHEMBL8823234 0.82 PRCP (0.97) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
SCHEMBL17361886 0.77 KDM4C (0.60) PRCPSLC22A1KDM4CRECQLOPRM1
SCHEMBL30199336 0.77 CHRM2 (0.47) PRCPSLC22A1KDM4CRECQLGSK3B
Urea SCHEMBL28457637 0.76 PRCP (0.83) PRCPSLC22A1ADRB2OPRM1SMN1; SMN2
SCHEMBL10728169 0.75 PRCP (0.77) PRCPSLC22A1ADRB2KDM4EGAA

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