SCHEMBL9529202

SCHEMBL9529202

CN(C)CC1c2ccc(O)cc2CCN1C(=O)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 7/20 0.68
OPRD1 P41143 7/20 0.67

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
SCHEMBL9528102 0.93 OPRK1 (0.67) OPRK1OPRD1
SCHEMBL9528674 0.92 OPRD1 (0.70) OPRK1OPRD1
Hydrochloric Acid SCHEMBL9531229 0.91 OPRD1 (0.69) OPRK1OPRD1
SCHEMBL9815269 0.89 OPRD1 (0.83) OPRK1OPRD1
SCHEMBL9529417 0.88 OPRK1 (0.64) OPRK1OPRD1
Hydrochloric Acid SCHEMBL9815302 0.88 OPRD1 (0.81) OPRK1OPRD1
Hydrochloric Acid SCHEMBL9530248 0.88 OPRK1 (0.62) OPRK1OPRD1
SCHEMBL9528122 0.86 OPRK1 (0.71) OPRK1OPRD1
SCHEMBL9529600 0.85 OPRD1 (0.72) OPRK1OPRD1
SCHEMBL9529938 0.84 OPRK1 (0.68) OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0330360-B1 1,2,3,4-Tetrahydroisoquinolines, processes for their preparation, and their use as kappa-receptor agonists SMITHKLINE BEECHAM FARMA (IT) 1993-12-01 EP claimed
EP-0330360-A1 1,2,3,4-Tetrahydroisoquinolines, processes for their preparation, and their use as kappa-receptor agonists SmithKline Beecham Farmaceutici S.p.A. (IT) 1989-08-30 EP claimed
EP-0330360-B1 1,2,3,4-Tetrahydroisoquinolines, processes for their preparation, and their use as kappa-receptor agonists SMITHKLINE BEECHAM FARMA (IT) 1993-12-01 EP disclosed
US-4954509-A Isoquinoline derivatives and their use as analgesics DR. LO. ZAMBELETTI S.P.A. (IT) 1990-09-04 US disclosed
EP-0330360-A1 1,2,3,4-Tetrahydroisoquinolines, processes for their preparation, and their use as kappa-receptor agonists SmithKline Beecham Farmaceutici S.p.A. (IT) 1989-08-30 EP disclosed