SCHEMBL5568958

SCHEMBL5568958

Fc1cccc(OC[C@@H]2Cc3ccccc3CN2)c1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.51
OPRM1 P35372 1/20 0.46
OPRL1 P41146 1/20 0.46
KCNH2 Q12809 1/20 0.46
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42

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
SCHEMBL5568961 1.00 PNMT (0.51) PNMTOPRM1OPRL1KCNH2CHRNB4
SCHEMBL14102444 0.85 PNMT (0.55) PNMTOPRM1OPRL1KCNH2
SCHEMBL3130633 0.76 PNMT (0.55) PNMTOPRM1OPRL1KCNH2
SCHEMBL16889040 0.74 LTA4H (0.40) PNMTOPRM1OPRL1KCNH2
SCHEMBL9241941 0.73 CHRNB4 (0.70) CHRNB4CHRNA3
SCHEMBL4664872 0.73 CHRNB4 (0.70) CHRNB4CHRNA3
SCHEMBL9241944 0.73 CHRNB4 (0.70) CHRNB4CHRNA3
SCHEMBL16879115 0.73 PNMT (0.48) PNMT
SCHEMBL16879112 0.73 PNMT (0.48) PNMT
Hydrochloric Acid SCHEMBL9244609 0.72 CHRNB4 (0.68) CHRNB4CHRNA3

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-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
EP-1828138-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-09-05 EP disclosed
WO-2005113510-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-01 WO disclosed
WO-2005113510-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-01 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-20070265301-A1 Dpp-IV Inhibitors DPP4, DPP8, DPP7 PNMT 1660/4885OPRM1 1256/4885OPRL1 1177/4885

“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.