SCHEMBL651020

SCHEMBL651020

CC1(N2CCC(N3C(=O)N[C@@H]4CCCC[C@H]43)CC2)CCN(C(=O)C2CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 9/20 0.48
OPRM1 P35372 8/20 0.48
CCR5 P51681 5/20 0.47
OPRK1 P41145 3/20 0.45
OPRD1 P41143 1/20 0.44
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 2/20 0.33
CYP2C19 P33261 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL648201 1.00 OPRL1 (0.48) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL3655122 0.88 OPRL1 (0.50) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL16494167 0.88 OPRL1 (0.50) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL16494165 0.88 OPRL1 (0.50) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL16493957 0.88 OPRL1 (0.50) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL16494163 0.88 OPRL1 (0.50) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL650691 0.88 OPRL1 (0.47) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL10092903 0.85 OPRL1 (0.47) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL3648812 0.84 OPRL1 (0.48) OPRL1OPRM1CCR5OPRK1OPRD1
SCHEMBL3650548 0.84 OPRL1 (0.48) OPRL1OPRM1CCR5OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197843-B1 PIPERIDINE DERIVATIVES AS AGONISTS OF MUSCARINIC RECEPTORS ASTRAZENECA AB (SE) 2011-12-28 EP claimed
US-20090076078-A1 New compounds 966 ASTRAZENECA AB (SE) 2009-03-19 US claimed
US-8119661-B2 Piperidine derivatives and their use as muscarinic receptor modulators ASTRAZENECA AB (SE) 2012-02-21 US disclosed
US-8119661-B2 Piperidine derivatives and their use as muscarinic receptor modulators ASTRAZENECA AB (SE) 2012-02-21 US disclosed
US-8119661-B2 Piperidine derivatives and their use as muscarinic receptor modulators ASTRAZENECA AB (SE) 2012-02-21 US disclosed
EP-2197843-B1 PIPERIDINE DERIVATIVES AS AGONISTS OF MUSCARINIC RECEPTORS ASTRAZENECA AB (SE) 2011-12-28 EP disclosed
EP-2197843-B1 PIPERIDINE DERIVATIVES AS AGONISTS OF MUSCARINIC RECEPTORS ASTRAZENECA AB (SE) 2011-12-28 EP disclosed
EP-2197843-A1 PIPERIDINE DERIVATIVES AS AGONISTS OF MUSCARINIC RECEPTORS AstraZeneca AB (SE) 2010-06-23 EP disclosed
WO-2009034380-A1 PIPERIDINE DERIVATIVES AS AGONISTS OF MUSCARINIC RECEPTORS ASTRAZENECA AB (SE) 2009-03-19 WO disclosed
US-20090076078-A1 New compounds 966 ASTRAZENECA AB (SE) 2009-03-19 US disclosed
US-20090076078-A1 New compounds 966 ASTRAZENECA AB (SE) 2009-03-19 US disclosed
US-20090076078-A1 New compounds 966 ASTRAZENECA AB (SE) 2009-03-19 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-20090076078-A1 New compounds 966 OPRM1, OPRL1, OPRK1 OPRL1 2/4885OPRM1 1/4885CCR5 940/4885

“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.