SCHEMBL5401977

SCHEMBL5401977

COC1(c2cccc(N)c2)C2CCC1CN(Cc1ccccc1)C2

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 13/20 0.47
OPRK1 P41145 1/20 0.43
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41

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
SCHEMBL5395177 0.86 OPRM1 (0.50) OPRM1OPRK1
SCHEMBL5401139 0.86 OPRM1 (0.45) OPRM1
SCHEMBL5406788 0.83 DRD3 (0.47) OPRM1CHRM3
SCHEMBL5394580 0.81 FUCA1 (0.46) OPRM1OPRK1CHRM2CHRM3
SCHEMBL21220506 0.81 OPRM1 (0.50) OPRM1
SCHEMBL21220646 0.81 OPRM1 (0.52) OPRM1OPRK1
SCHEMBL21220648 0.81 OPRM1 (0.52) OPRM1OPRK1
SCHEMBL21220511 0.81 OPRM1 (0.50) OPRM1
SCHEMBL21237925 0.81 OPRM1 (0.50) OPRM1
SCHEMBL21220644 0.81 OPRM1 (0.52) OPRM1OPRK1

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-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 3/4885OPRK1 2/4885CHRM2 352/4885

“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.