SCHEMBL9966166

SCHEMBL9966166

C=C(C)OC(=O)N[C@@H]1Cc2ccc(O)cc2N(OC)C1=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.35
ESR1 P03372 4/20 0.34
PYGL P06737 13/20 0.34
PYGM P11217 10/20 0.34
OPRM1 P35372 2/20 0.31
OPRD1 P41143 1/20 0.31

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
SCHEMBL23119152 0.84 GAA (0.38) ESR2ESR1PYGLPYGM
SCHEMBL23119153 0.75 NPY1R (0.45)
SCHEMBL14193208 0.73 PYGL (0.43) PYGLPYGM
SCHEMBL7419284 0.72 AADAT (0.40) PYGLPYGM
SCHEMBL7423564 0.72 KYAT1 (0.46) PYGLPYGM
SCHEMBL9974770 0.70 LIPG (0.39) PYGLPYGM
SCHEMBL4800991 0.68 PYGL (0.43) PYGLPYGM
SCHEMBL4800980 0.68 PYGL (0.43) PYGLPYGM
SCHEMBL4799822 0.68 MTNR1A (0.49) PYGLPYGM
SCHEMBL4799807 0.68 MTNR1A (0.49) PYGLPYGM

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-20120157383-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-06-21 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-20120157383-A1 NEPRILYSIN INHIBITORS MME, REN, ACE ESR2 2695/4885ESR1 2683/4885PYGL 3107/4885

“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.