SCHEMBL14102444

SCHEMBL14102444

Fc1ccc(OC[C@@H]2Cc3ccccc3CN2)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 3/20 0.55
LTA4H P09960 1/20 0.48
OPRM1 P35372 1/20 0.43
OPRL1 P41146 1/20 0.43
KCNH2 Q12809 1/20 0.43
CXCR4 P61073 1/20 0.42
NR1D1 P20393 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
SCHEMBL5568961 0.85 PNMT (0.51) PNMTOPRM1OPRL1KCNH2
SCHEMBL5568958 0.85 PNMT (0.51) PNMTOPRM1OPRL1KCNH2
SCHEMBL16879112 0.82 PNMT (0.48) PNMTLTA4HNR1D1
SCHEMBL16879115 0.82 PNMT (0.48) PNMTLTA4HNR1D1
SCHEMBL16889040 0.80 LTA4H (0.40) PNMTLTA4HOPRM1OPRL1KCNH2
SCHEMBL16878941 0.78 LTA4H (0.39) PNMTLTA4HOPRM1OPRL1KCNH2
SCHEMBL16878940 0.78 LTA4H (0.39) PNMTLTA4HOPRM1OPRL1KCNH2
SCHEMBL3119353 0.77 PNMT (0.60) PNMTOPRM1OPRL1KCNH2CXCR4
SCHEMBL16878923 0.77 NR1D1 (0.46) PNMTLTA4HOPRM1OPRL1KCNH2
SCHEMBL16878925 0.77 NR1D1 (0.46) PNMTLTA4HOPRM1OPRL1KCNH2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176838-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (DEUTSCHLAND) AG (DE) 2008-07-24 US 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-20080176838-A1 Dpp-IV Inhibitors DPP4, DPP9, DPP7 PNMT 2091/4885LTA4H 936/4885OPRM1 1802/4885

“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.