SCHEMBL5879387

SCHEMBL5879387

CCN(CC)C(=O)c1ccc(N(c2c(F)cccc2C(N)=O)C2CCN(Cc3ccccn3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 20/20 0.59
OPRM1 P35372 17/20 0.59
OPRK1 P41145 13/20 0.56

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
SCHEMBL5829869 0.91 OPRM1 (0.47) OPRD1OPRM1OPRK1
SCHEMBL5879389 0.89 OPRD1 (0.66) OPRD1OPRM1OPRK1
SCHEMBL5879321 0.88 OPRD1 (0.76) OPRD1OPRM1OPRK1
SCHEMBL5879363 0.87 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL5879360 0.86 OPRD1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL5879375 0.86 OPRD1 (0.55) OPRD1OPRM1OPRK1
SCHEMBL5879369 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL5879337 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL5879393 0.85 OPRD1 (0.59) OPRD1OPRM1OPRK1
SCHEMBL5879322 0.85 OPRD1 (0.66) OPRD1OPRM1OPRK1

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
EP-1395558-B1 4-(PHENYL-(PIPERIDIN-4-YL)-AMINO)-BENZAMIDE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PAIN, ANXIETY OR GASTROINTESTINAL DISORDERS ASTRAZENECA AB (SE) 2005-12-21 EP claimed
US-20040152731-A1 4-(Phenyl-(piperidin-4-yl)-amino)-benzamide derivaties and their use for the treatment of pain, anxiety or gastrointestinal disorders ASTRAZENECA AB (SE) 2004-08-05 US claimed
EP-1395558-A1 4-(PHENYL-(PIPERIDIN-4-YL)-AMINO)-BENZAMIDE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PAIN, ANXIETY OR GASTROINTESTINAL DISORDERS AstraZeneca AB (SE) 2004-03-10 EP claimed
WO-2002094783-A1 4-(PHENYL-(PIPERIDIN-4-YL)-AMINO)-BENZAMIDE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PAIN, ANXIETY OR GASTROINTESTINAL DISORDERS ASTRAZENECA AB (SE) 2002-11-28 WO claimed
US-7064137-B2 Analgesics; anxiolytic agents; gastrointestinal disorders ASTRAZENECA AB (SE) 2006-06-20 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-20040152731-A1 4-(Phenyl-(piperidin-4-yl)-amino)-benzamide derivaties and their use for the treatment of pain, anxiety or gastrointestinal disorders HTR2C, OPRK1, OPRL1 OPRD1 4/4885OPRM1 8/4885OPRK1 2/4885

“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.