SCHEMBL17438951

SCHEMBL17438951

CN(C)C1(C2CCCC2)CCC2(CC1)CC(=O)N(CC1COC1)C2

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.44
OPRL1 P41146 3/20 0.44
USP19 O94966 1/20 0.32
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL17438691 0.92 OPRM1 (0.42) OPRM1OPRL1USP19
SCHEMBL17438688 0.92 OPRM1 (0.42) OPRM1OPRL1USP19
SCHEMBL17438730 0.90 OPRM1 (0.47) OPRM1OPRL1USP19CTSBCTSS
SCHEMBL17438689 0.90 OPRM1 (0.50) OPRM1OPRL1USP19CTSBCTSS
SCHEMBL17438769 0.89 OPRM1 (0.46) OPRM1OPRL1USP19CTSBCTSS
SCHEMBL17438728 0.89 OPRM1 (0.46) OPRM1OPRL1USP19CTSBCTSS
SCHEMBL17439008 0.88 OPRM1 (0.42) OPRM1OPRL1USP19
SCHEMBL17438996 0.81 OPRM1 (0.48) OPRM1OPRL1USP19
SCHEMBL17438709 0.80 OPRM1 (0.45) OPRM1OPRL1USP19
SCHEMBL17439059 0.78 OPRM1 (0.43) OPRM1OPRL1USP19

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
US-10202345-B2 Substituted azaspiro(4.5)decane derivatives GRUENENTHAL GMBH (DE) 2019-02-12 US claimed
EP-3169665-B1 SUBSTITUTED AZA-SPIRO(4.5)DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2018-05-09 EP claimed
EP-3169665-A1 SUBSTITUTED AZA-SPIRO(4.5)DECAN-DERIVATIVES Grünenthal GmbH (DE) 2017-05-24 EP claimed
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2016-01-21 US claimed
WO-2016008583-A1 SUBSTITUTED AZA-SPIRO(4.5)DECAN-DERIVATIVES Grünenthal GmbH (DE) 2016-01-21 WO claimed

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

For each of this compound's patents that has machine-readable text (2 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 1/4885USP19 4502/4885
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885USP19 4502/4885

“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.