SCHEMBL17438590

SCHEMBL17438590

CCOC(=O)C=C1CCC(c2ccccc2)(N(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 16/20 0.52
▸ OPRL1 P41146 14/20 0.52
▸ OPRK1 P41145 3/20 0.47
▸ ESR2 Q92731 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL3411088 0.85 OPRM1 (0.41) OPRM1OPRL1ESR2L3MBTL1
SCHEMBL2378581 0.85 OPRM1 (0.53) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL2378578 0.83 OPRM1 (0.51) OPRM1OPRL1OPRK1
SCHEMBL2781209 0.83 OPRM1 (0.57) OPRM1OPRL1OPRK1
Hydrochloric Acid SCHEMBL2380060 0.81 OPRL1 (0.55) OPRM1OPRL1OPRK1
SCHEMBL13650546 0.80 L3MBTL1 (0.52) OPRM1OPRL1OPRK1L3MBTL1
SCHEMBL17438643 0.80 OPRM1 (0.46) OPRM1OPRL1ESR2
SCHEMBL17438882 0.79 SLC6A4 (0.43) OPRM1OPRK1ESR2
SCHEMBL303247 0.78 OPRL1 (0.63) OPRM1OPRL1OPRK1
SCHEMBL2379110 0.78 OPRM1 (0.49) OPRM1OPRL1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202345-B2 Substituted azaspiro(4.5)decane derivatives GRUENENTHAL GMBH (DE) 2019-02-12 — — US disclosed
EP-3169666-B1 SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2018-06-06 — — EP disclosed
EP-3169666-B1 SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2018-06-06 — — EP disclosed
US-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2017-07-27 — — US disclosed
US-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2017-07-27 — — US disclosed
EP-3169666-A1 SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES Grünenthal GmbH (DE) 2017-05-24 — — EP disclosed
CN-106660954-A Substituted azaspiro(4.5)decane derivatives 格吕伦塔尔有限公司 2017-05-10 — — CN disclosed
WO-2016008582-A1 SUBSTITUTED AZASPIRO(4.5)DECANE DERIVATIVES Grünenthal GmbH (DE) 2016-01-21 — — WO disclosed
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2016-01-21 — — 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-10202345-B2 Substituted azaspiro(4.5)decane derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 5/4885
US-20170210734-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRM1, OPRD1 OPRM1 2/4885OPRL1 1/4885OPRK1 4/4885
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 5/4885

“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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