SCHEMBL1987152

SCHEMBL1987152

COc1cccc(C(c2ccc(C(=O)N3CCCC3)cc2)N2C3CCC2C2CCC3N2)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.54
OPRD1 P41143 4/20 0.54
HPGD P15428 1/20 0.46
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL12564509 1.00 OPRM1 (0.54) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL12564528 1.00 OPRM1 (0.54) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL1988658 1.00 OPRM1 (0.54) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL12564511 0.99 OPRM1 (0.55) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL12564523 0.99 OPRM1 (0.55) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL1987827 0.99 OPRM1 (0.55) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL1987025 0.99 OPRM1 (0.55) OPRM1OPRD1HPGDALDH1A1PKM
SCHEMBL12564524 0.84 OPRM1 (0.53) OPRM1OPRD1
SCHEMBL1990579 0.84 OPRM1 (0.53) OPRM1OPRD1
SCHEMBL12564547 0.83 OPRM1 (0.67) OPRM1OPRD1

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-8609659-B2 Substituted 3,8-diazabicyclo[3.2.1]octane compounds NEUROSCIENZE PHARMANESS S.C.A.R.L. (IT) 2013-12-17 US disclosed
EP-2338889-B1 Diazacyclic compounds having affinity for opioid receptors NEUROSCIENZE PHARMANESS S C A R L (IT) 2012-08-29 EP disclosed
EP-2338889-A1 Diazacyclic compounds having affinity for opioid receptors Neuroscienze Pharmaness S.C. A R.L. (IT) 2011-06-29 EP disclosed
US-20110152238-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENZE PHARMANESS S.C. A.R.L. (IT) 2011-06-23 US disclosed
US-20110152238-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENZE PHARMANESS S.C. A.R.L. (IT) 2011-06-23 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 (1 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-20110152238-A1 PHARMACEUTICAL COMPOUNDS OPRD1, OPRK1, OPRM1 OPRM1 3/4885OPRD1 1/4885HPGD 1594/4885

“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.