SCHEMBL5489607

SCHEMBL5489607

CCN(CC)C(=O)c1ccc(C(=C2CCN(C(=O)OC(C)(C)C)CC2)c2ccc(C#N)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.57
OPRD1 P41143 13/20 0.51
OPRK1 P41145 8/20 0.49
OPRM1 P35372 10/20 0.47

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
SCHEMBL5441915 0.86 GPR119 (0.55) GPR119OPRD1OPRK1OPRM1
SCHEMBL4999880 0.86 OPRD1 (0.54) GPR119OPRD1OPRK1OPRM1
SCHEMBL14564242 0.82 OPRD1 (0.73) OPRD1OPRK1OPRM1
SCHEMBL5367295 0.82 OPRD1 (0.57) OPRD1OPRK1OPRM1
SCHEMBL5218154 0.82 OPRD1 (0.59) OPRD1OPRK1OPRM1
SCHEMBL1602493 0.82 GPR119 (0.50) GPR119OPRD1
SCHEMBL5954803 0.81 OPRD1 (0.64) OPRD1OPRK1OPRM1
SCHEMBL14543729 0.81 OPRD1 (0.53) GPR119OPRD1OPRK1OPRM1
SCHEMBL14572964 0.81 OPRD1 (0.53) GPR119OPRD1OPRK1OPRM1
SCHEMBL1603972 0.80 OPRD1 (0.52) GPR119OPRD1OPRK1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066655-A1 Diarylmethylidene piperidine derivatives and their use as delta opiod receptor agonists ATRAZENECA AB (SE) 2007-03-22 US disclosed
US-20070066655-A1 Diarylmethylidene piperidine derivatives and their use as delta opiod receptor agonists ATRAZENECA AB (SE) 2007-03-22 US disclosed
EP-1626960-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPIOID RECEPTOR AGONISTS AstraZeneca AB (SE) 2006-02-22 EP disclosed
WO-2004101520-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPIOD RECEPTOR AGONISTS ASTRAZENECA AB (SE) 2004-11-25 WO 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-20070066655-A1 Diarylmethylidene piperidine derivatives and their use as delta opiod receptor agonists OPRD1, OPRM1, OPRL1 GPR119 173/4885OPRD1 1/4885OPRK1 4/4885

“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.