SCHEMBL3086835

SCHEMBL3086835

CCC(=O)N(CC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.69
OPRD1 P41143 4/20 0.65
OPRM1 P35372 3/20 0.58
SIGMAR1 Q99720 2/20 0.58

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
SCHEMBL3098485 0.93 ACHE (0.78) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL3081580 0.90 OPRM1 (0.59) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL3083237 0.86 OPRM1 (0.59) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL3094944 0.81 OPRM1 (0.68) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL14601860 0.81 ACHE (1.00) ACHEOPRM1SIGMAR1
Hydrochloric Acid SCHEMBL3089658 0.81 OPRM1 (0.67) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL5870943 0.80 ACHE (0.62) ACHEOPRD1OPRM1SIGMAR1
SCHEMBL3646634 0.79 OPRM1 (0.55) ACHEOPRD1OPRM1
SCHEMBL3083010 0.79 OPRM1 (0.65) OPRD1OPRM1SIGMAR1
SCHEMBL19658490 0.78 ACHE (0.63) ACHEOPRM1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234427-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2010-09-16 US claimed
EP-1987001-B1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH AS (DK) 2010-05-05 EP claimed
EP-1987001-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NeuroSearch A/S (DK) 2008-11-05 EP claimed
WO-2007093603-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2007-08-23 WO claimed
US-20100234427-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2010-09-16 US disclosed
EP-1987001-B1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH AS (DK) 2010-05-05 EP 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-20100234427-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS OPRL1, OPRM1, OPRK1 ACHE 217/4885OPRD1 4/4885OPRM1 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.