SCHEMBL17438745

SCHEMBL17438745

CCCC(=O)N1CCC2(CCC(c3ccc(F)s3)(N(C)C)CC2)C1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 11/20 0.64
OPRL1 P41146 10/20 0.64
HSD11B1 P28845 3/20 0.39
EPHX2 P34913 1/20 0.37
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NPY5R Q15761 1/20 0.32

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
SCHEMBL17439010 0.88 OPRM1 (0.66) OPRM1OPRL1HSD11B1EPHX2ITGB3
SCHEMBL17438660 0.87 OPRM1 (0.64) OPRM1OPRL1HSD11B1EPHX2ITGB3
SCHEMBL17438597 0.83 OPRM1 (0.69) OPRM1OPRL1HSD11B1ITGB3ITGA2B
SCHEMBL17438955 0.83 OPRM1 (0.46) OPRM1OPRL1HSD11B1EPHX2
SCHEMBL17444003 0.80 OPRM1 (0.47) OPRM1OPRL1
SCHEMBL17439006 0.80 HDAC2 (0.45) OPRM1OPRL1
SCHEMBL17438678 0.79 OPRM1 (0.40) OPRM1OPRL1HSD11B1EPHX2
SCHEMBL17438708 0.79 OPRM1 (0.53) OPRM1OPRL1HSD11B1ITGB3ITGA2B
SCHEMBL17438976 0.78 OPRM1 (1.00) OPRM1OPRL1HSD11B1
SCHEMBL17439156 0.78 OPRM1 (0.39) OPRM1OPRL1HSD11B1

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.