SCHEMBL20212944

SCHEMBL20212944

CC(C)(C)[C@H]1CC[C@@H](N2CCC(n3cc(CCN)c4cc(OS(N)(=O)=O)ccc43)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 16/20 0.51
▸ OPRL1 P41146 16/20 0.51
▸ OPRK1 P41145 12/20 0.51
▸ HTR6 P50406 2/20 0.38
▸ OPRD1 P41143 1/20 0.37
▸ ADRB2 P07550 1/20 0.37
▸ CYP19A1 P11511 1/20 0.36

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
SCHEMBL30677437 1.00 OPRM1 (0.51) OPRM1OPRL1OPRK1HTR6OPRD1
SCHEMBL20212945 1.00 OPRM1 (0.51) OPRM1OPRL1OPRK1HTR6OPRD1
SCHEMBL30813258 0.88 OPRL1 (0.68) OPRM1OPRL1OPRK1OPRD1
SCHEMBL20213142 0.88 OPRL1 (0.68) OPRM1OPRL1OPRK1OPRD1
SCHEMBL20213143 0.88 OPRL1 (0.68) OPRM1OPRL1OPRK1OPRD1
SCHEMBL20212979 0.86 OPRL1 (0.49) OPRM1OPRL1OPRK1HTR6OPRD1
SCHEMBL30677510 0.86 OPRL1 (0.49) OPRM1OPRL1OPRK1HTR6OPRD1
SCHEMBL20212865 0.82 OPRL1 (0.54) OPRM1OPRL1OPRK1OPRD1
SCHEMBL20212863 0.82 OPRL1 (0.54) OPRM1OPRL1OPRK1OPRD1
SCHEMBL23004778 0.80 OPRL1 (0.67) OPRM1OPRL1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059664-A1 Piperidinyl Nociceptin Receptor Compounds ASTRAEA THERAPEUTICS, LLC 2024-02-22 — — US disclosed
US-RE49825-E1 Piperidinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2024-02-06 — — US disclosed
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-10829471-B2 Piperidinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC 2020-11-10 — — US disclosed
US-20190300500-A1 PIPERIDINYL NOCICEPTIN RECEPTOR COMPOUNDS ASTRAEA THERAPEUTICS, LLC 2019-10-03 — — US disclosed
US-10358432-B2 Piperdinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2019-07-23 — — US disclosed
US-10358432-B2 Piperdinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2019-07-23 — — US disclosed
US-20180312486-A1 PIPERDINYL NOCICEPTIN RECEPTOR COMPOUNDS ASTRAEA THERAPEUTICS, LLC 2018-11-01 — — US disclosed
US-10112924-B2 Piperdinyl nociceptin receptor compounds Astraea Therapeutics, Inc. (US) 2018-10-30 — — US disclosed
US-20180155314-A1 PIPERDINYL NOCICEPTIN RECEPTOR COMPOUNDS ASTRAEA THERAPEUTICS, LLC 2018-06-07 — — 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 (9 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-10112924-B2 Piperdinyl nociceptin receptor compounds OPRL1, OPRK1, OPRD1 OPRM1 4/4885OPRL1 1/4885OPRK1 2/4885
US-11827617-B2 Piperidinyl nociceptin receptor compounds OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 2/4885
US-10829471-B2 Piperidinyl nociceptin receptor compounds OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 2/4885
US-20210053937-A1 PIPERIDINYL NOCICEPTIN RECEPTOR COMPOUNDS OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 2/4885
US-20180312486-A1 PIPERDINYL NOCICEPTIN RECEPTOR COMPOUNDS OPRL1, OPRK1, OPRD1 OPRM1 4/4885OPRL1 1/4885OPRK1 2/4885
US-10358432-B2 Piperdinyl nociceptin receptor compounds OPRL1, OPRK1, OPRD1 OPRM1 4/4885OPRL1 1/4885OPRK1 2/4885
US-20190300500-A1 PIPERIDINYL NOCICEPTIN RECEPTOR COMPOUNDS OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 2/4885
US-20180155314-A1 PIPERDINYL NOCICEPTIN RECEPTOR COMPOUNDS OPRL1, OPRK1, OPRD1 OPRM1 4/4885OPRL1 1/4885OPRK1 2/4885
US-20240059664-A1 Piperidinyl Nociceptin Receptor Compounds OPRL1, OPRK1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 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.

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