SCHEMBL17439154

SCHEMBL17439154

COCC(C)(C)C(=O)N1CCC2(CCC(c3ccc(Cl)s3)(N(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.39
OPRL1 P41146 10/20 0.39
HSD11B1 P28845 2/20 0.36
EPHX2 P34913 1/20 0.34
F2 P00734 1/20 0.33
TSHR P16473 2/20 0.32
RIPK1 Q13546 1/20 0.32
CYP2D6 P10635 3/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
CASP1 P29466 1/20 0.32
CYP2C19 P33261 2/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL17439084 0.89 OPRM1 (0.41) OPRM1OPRL1HSD11B1EPHX2TSHR
SCHEMBL17438610 0.83 OPRM1 (0.51) OPRM1OPRL1HSD11B1EPHX2
SCHEMBL17439116 0.81 OPRM1 (0.40) OPRM1OPRL1HSD11B1EPHX2TSHR
SCHEMBL17438894 0.81 OPRM1 (0.61) OPRM1OPRL1HSD11B1
SCHEMBL17438823 0.80 OPRM1 (0.39) OPRM1OPRL1HSD11B1TSHRCYP2D6
SCHEMBL17438660 0.79 OPRM1 (0.64) OPRM1OPRL1HSD11B1EPHX2
SCHEMBL19137880 0.76 OPRM1 (0.47) OPRM1OPRL1TSHRCYP2D6ALDH1A1
SCHEMBL17444131 0.73 OPRM1 (0.44) OPRM1OPRL1
SCHEMBL17444127 0.73 OPRM1 (0.44) OPRM1OPRL1
SCHEMBL17438631 0.72 OPRM1 (0.48) OPRM1OPRL1TSHRCYP2D6ALDH1A1

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 1/4885HSD11B1 1377/4885
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885HSD11B1 1377/4885

“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.