SCHEMBL5398798

SCHEMBL5398798

COC1(c2cccc(C(N)=O)c2)C2CCC1CN(Cc1cnc3ccccc3c1)C2

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 15/20 0.55
DPP4 P27487 1/20 0.47
DPP8 Q6V1X1 1/20 0.47
FAAH O00519 3/20 0.46

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
SCHEMBL5406334 0.87 DPP4 (0.49) OPRM1DPP4DPP8FAAH
SCHEMBL5406224 0.86 OPRM1 (0.59) OPRM1
SCHEMBL5399554 0.82 FAAH (0.44) OPRM1DPP4DPP8FAAH
SCHEMBL5401142 0.82 OPRM1 (0.60) OPRM1
SCHEMBL21221052 0.81 OPRM1 (0.71) OPRM1
SCHEMBL21238057 0.81 OPRM1 (0.71) OPRM1
SCHEMBL21221058 0.81 OPRM1 (0.71) OPRM1
SCHEMBL21221055 0.81 OPRM1 (0.71) OPRM1
Hydrochloric Acid SCHEMBL21220800 0.81 OPRM1 (0.69) OPRM1
Hydrochloric Acid SCHEMBL21220801 0.81 OPRM1 (0.69) OPRM1

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-7241887-B2 3-azabicyclo[3.2.1]octane derivatives PFIZER INC (US) 2007-07-10 US claimed
US-20040259859-A1 3-Azabicyclo[3.2.1]octane derivatives PFIZER INC 2004-12-23 US claimed
US-7241887-B2 3-azabicyclo[3.2.1]octane derivatives PFIZER INC (US) 2007-07-10 US disclosed
EP-1615894-A2 3-AZABICYCLO 3.2.1 OCTANE DERIVATIVES Pfizer Products Inc. (US) 2006-01-18 EP disclosed
US-20040259859-A1 3-Azabicyclo[3.2.1]octane derivatives PFIZER INC 2004-12-23 US disclosed
WO-2004089908-A2 3-AZABICYCLO[3.2.1]OCTANE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-10-21 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-20040259859-A1 3-Azabicyclo[3.2.1]octane derivatives OPRD1, OPRK1, OPRM1 OPRM1 3/4885DPP4 3398/4885DPP8 2943/4885

“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.