SCHEMBL5525517

SCHEMBL5525517

CCCN1CCN(C(c2ccc(C(=O)N(CC)CC)cc2)c2cccc(NC(=O)O)c2)CC1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 16/20 0.76
OPRM1 P35372 3/20 0.67
OPRK1 P41145 2/20 0.61
KCNH2 Q12809 6/20 0.61

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
SCHEMBL5525511 1.00 OPRD1 (0.76) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5977141 1.00 OPRD1 (0.76) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5975417 0.94 OPRD1 (0.77) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5976396 0.94 OPRD1 (0.72) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5975409 0.94 OPRD1 (0.72) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5975405 0.94 OPRD1 (0.72) OPRD1OPRM1OPRK1KCNH2
SCHEMBL14343504 0.93 OPRD1 (0.73) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5522686 0.92 OPRD1 (0.65) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5522677 0.92 OPRD1 (0.65) OPRD1OPRM1OPRK1KCNH2
SCHEMBL5521740 0.91 OPRD1 (0.74) OPRD1OPRM1OPRK1KCNH2

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-20070293502-A1 Diarylmethyl Piperazine Derivatives, Preparations Thereof and Uses Thereof ASTRAZENECA AB (SE) 2007-12-20 US claimed
EP-1706393-A1 DIARYLMETHYL PIPERAZINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-10-04 EP claimed
WO-2005066148-A1 DIARYLMETHYL PIPERAZINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2005-07-21 WO claimed
US-20070293502-A1 Diarylmethyl Piperazine Derivatives, Preparations Thereof and Uses Thereof ASTRAZENECA AB (SE) 2007-12-20 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-20070293502-A1 Diarylmethyl Piperazine Derivatives, Preparations Thereof and Uses Thereof OPRL1, OPRM1, PTGER3 OPRD1 10/4885OPRM1 2/4885OPRK1 7/4885

“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.