SCHEMBL30008262

SCHEMBL30008262

Cc1nn(C)c(C)c1[C@H]1CCCN1Cc1ccc(Oc2ccc(C(N)=O)cc2F)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 20/20 0.71
▸ OPRM1 P35372 16/20 0.71
▸ OPRD1 P41143 11/20 0.71

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
SCHEMBL20202199 1.00 OPRK1 (0.71) OPRK1OPRM1OPRD1
SCHEMBL20202208 0.89 OPRK1 (0.55) OPRK1OPRM1OPRD1
SCHEMBL20202203 0.88 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL30008019 0.88 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL20187363 0.88 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL20187330 0.86 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL20187291 0.86 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL30007556 0.86 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL20202202 0.84 OPRK1 (0.72) OPRK1OPRM1OPRD1
SCHEMBL30007555 0.83 OPRK1 (0.70) OPRK1OPRM1OPRD1

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
EP-3544972-B1 HETEROARYLPHENOXY BENZAMIDE KAPPA OPIOID LIGANDS PFIZER (US) 2023-04-26 — — EP claimed
CN-110234638-B Heteroaryl phenoxy benzamide KAPPA opioid ligands 辉瑞大药厂 2022-10-21 — — CN claimed
EP-3544972-B1 HETEROARYLPHENOXY BENZAMIDE KAPPA OPIOID LIGANDS PFIZER (US) 2023-04-26 — — EP disclosed
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