SCHEMBL4644940

SCHEMBL4644940

CN(Cc1ccccc1)C1(COc2cccnc2)CC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45
CHRNB2 P17787 4/20 0.44
CHRNA4 P43681 4/20 0.44
LMNA P02545 1/20 0.39

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
SCHEMBL5426512 0.80 OPRM1 (0.44) OPRM1OPRL1CHRNB2CHRNA4LMNA
SCHEMBL4642479 0.80 OPRM1 (0.44) OPRM1OPRL1CHRNB2CHRNA4LMNA
SCHEMBL6138358 0.72 CHRNB2 (0.47) CHRNB2CHRNA4
SCHEMBL6138002 0.70 CHRNB2 (0.55) CHRNB2CHRNA4
SCHEMBL4643126 0.70 CHRNB2 (0.51) CHRNB2CHRNA4
SCHEMBL4643121 0.70 CHRNB2 (0.51) CHRNB2CHRNA4
SCHEMBL4643117 0.70 CHRNB2 (0.51) CHRNB2CHRNA4
SCHEMBL4642788 0.70 OPRM1 (0.46) OPRM1OPRL1LMNA
Hydrochloric Acid SCHEMBL6291543 0.69 CHRNB2 (0.54) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL5118971 0.69 CHRNB2 (0.50) CHRNB2CHRNA4

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
EP-1748043-B1 Polysubstituted 1,1-pyridinyloxycyclopropanamine derivatives, process for their préparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2008-08-20 EP disclosed
US-7348344-B2 Polysubstituted 1,1-pyridyloxycyclopropanamine compounds LES LABORATOIRES SERVIER (FR) 2008-03-25 US disclosed
US-20070027191-A1 Polysubstituted 1,1-pyridyloxycyclopropanamine compounds LES LABORATOIRES SERVIER (FR) 2007-02-01 US disclosed
EP-1748043-A1 Polysubstituted 1,1-pyridinyloxycyclopropanamine derivatives, process for their préparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2007-01-31 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-20070027191-A1 Polysubstituted 1,1-pyridyloxycyclopropanamine compounds CHRM1, CHRNA1, CHRNA9 OPRM1 39/4885OPRL1 42/4885CHRNB2 22/4885

“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.