SCHEMBL3084744

SCHEMBL3084744

Oc1cccc(C2(O)CCCNC2)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.43
OPRD1 P41143 3/20 0.40
SLC6A4 P31645 3/20 0.38
SLC6A2 P23975 2/20 0.38
OPRK1 P41145 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC22A1 O15245 1/20 0.36
CHRM2 P08172 1/20 0.36
ACHE P22303 1/20 0.36
CYP2D6 P10635 1/20 0.36
HTR2A P28223 1/20 0.36
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35

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
SCHEMBL13144705 0.83 OPRM1 (0.45) OPRM1OPRD1SLC6A2OPRK1ACHE
SCHEMBL12369440 0.83 OPRM1 (0.45) OPRM1OPRD1SLC6A4SLC6A2OPRK1
SCHEMBL8959998 0.83 SLC6A3 (0.42) OPRM1OPRD1SLC6A4SLC6A2OPRK1
Hydrochloric Acid SCHEMBL9311016 0.81 OPRM1 (0.44) OPRM1OPRD1SLC6A4SLC6A2OPRK1
Hydrochloric Acid SCHEMBL9310877 0.81 OPRM1 (0.44) OPRM1OPRD1SLC6A4SLC6A2OPRK1
Hydrochloric Acid SCHEMBL9311181 0.81 SLC6A3 (0.41) OPRM1OPRD1SLC6A4SLC6A2OPRK1
SCHEMBL1764933 0.81 HTR2A (0.50) OPRM1OPRD1SLC6A4OPRK1CYP2D6
SCHEMBL15093618 0.81 HTR2A (0.50) OPRM1OPRD1SLC6A4OPRK1CYP2D6
SCHEMBL15093858 0.81 HTR2A (0.50) OPRM1OPRD1SLC6A4OPRK1CYP2D6
Hydrochloric Acid SCHEMBL10754178 0.80 HTR2A (0.48) OPRM1OPRD1OPRK1CYP2D6HTR2A

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-7790898-B2 Substituted 3-phenylpiperidine compounds, their preparation and use GRUENENTHAL GMBH (DE) 2010-09-07 US disclosed
US-20070173533-A1 Substituted 3-phenylpiperidine compounds, their preparation and use GRUENENTHAL GMBH (DE) 2007-07-26 US disclosed
EP-1771417-A1 SUBSTITUTED 3-PHENYLPIPERIDINE DERIVATIVES Grünenthal GmbH (DE) 2007-04-11 EP disclosed
WO-2006010577-A1 SUBSTITUTED 3-PHENYLPIPERIDINE DERIVATIVES Grünenthal GmbH (DE) 2006-02-02 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-20070173533-A1 Substituted 3-phenylpiperidine compounds, their preparation and use OPRK1, OPRD1, OPRL1 OPRM1 4/4885OPRD1 2/4885SLC6A4 978/4885

“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.