SCHEMBL21179640

SCHEMBL21179640

NS(=O)(=O)Oc1ccc2c(c1)c(CN1CCCC1)cn2C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 18/20 0.42
▸ OPRM1 P35372 2/20 0.41
▸ OPRK1 P41145 2/20 0.41
▸ OPRL1 P41146 2/20 0.41
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2D6 P10635 2/20 0.35

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
SCHEMBL21179533 0.85 HTR6 (0.42) HTR6OPRM1OPRK1OPRL1
SCHEMBL21179646 0.84 OPRK1 (0.39) HTR6OPRM1OPRK1OPRL1
SCHEMBL21423425 0.82 OPRL1 (0.52) HTR6OPRM1OPRK1OPRL1
SCHEMBL30677702 0.82 OPRL1 (0.68) OPRM1OPRK1OPRL1
SCHEMBL20212849 0.82 OPRL1 (0.68) OPRM1OPRK1OPRL1
SCHEMBL20212848 0.82 OPRL1 (0.68) OPRM1OPRK1OPRL1
SCHEMBL21179650 0.80 HTR6 (0.40) HTR6OPRM1OPRK1OPRL1
SCHEMBL23004778 0.69 OPRL1 (0.67) OPRM1OPRK1OPRL1
SCHEMBL30677510 0.69 OPRL1 (0.49) HTR6OPRM1OPRK1OPRL1
SCHEMBL20212979 0.69 OPRL1 (0.49) HTR6OPRM1OPRK1OPRL1

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
US-11827617-B2 Piperidinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2023-11-28 — — US disclosed
US-20210053937-A1 PIPERIDINYL NOCICEPTIN RECEPTOR COMPOUNDS ASTRAEA THERAPEUTICS, LLC 2021-02-25 — — US disclosed
US-10358432-B2 Piperdinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2019-07-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11827617-B2 Piperidinyl nociceptin receptor compounds OPRL1, OPRK1, OPRM1 HTR6 188/4885OPRM1 3/4885OPRK1 2/4885
US-20210053937-A1 PIPERIDINYL NOCICEPTIN RECEPTOR COMPOUNDS OPRL1, OPRK1, OPRM1 HTR6 188/4885OPRM1 3/4885OPRK1 2/4885
US-10358432-B2 Piperdinyl nociceptin receptor compounds OPRL1, OPRK1, OPRD1 HTR6 195/4885OPRM1 4/4885OPRK1 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback