SCHEMBL5529429

SCHEMBL5529429

CC1CCC(C(CN)P(=O)(O)O)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
EPHX1 P07099 1/20 0.32
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 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
SCHEMBL7176500 1.00 ANPEP (0.33) ANPEPERAP2EPHX1GABBR2GABBR1
SCHEMBL7176498 1.00 ANPEP (0.33) ANPEPERAP2EPHX1GABBR2GABBR1
SCHEMBL5528741 0.90 ALDH1A1 (0.34) ANPEPERAP2EPHX1
SCHEMBL5537099 0.79 ANPEP (0.37) ANPEPERAP2GABBR2GABBR1
SCHEMBL6056283 0.79 ANPEP (0.37) ANPEPERAP2GABBR2GABBR1
SCHEMBL6056274 0.79 ANPEP (0.37) ANPEPERAP2GABBR2GABBR1
SCHEMBL5394771 0.75 TP53 (0.45) ANPEPERAP2EPHX1GABBR2GABBR1
SCHEMBL5394744 0.73 TP53 (0.48) ANPEPERAP2EPHX1
SCHEMBL5388081 0.73 TP53 (0.48) ANPEPERAP2EPHX1
SCHEMBL5386055 0.70 ANPEP (0.35) ANPEPERAP2GABBR2GABBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070161706-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY LLC (US) 2007-07-12 US disclosed
CN-1635887-A Combinations of an alpha-2-delta ligand with a selective inhibitor of cyclooxygenase-2 WARNER LAMBERT CO (US) 2005-07-06 CN 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-20070161706-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 ANPEP 2033/4885ERAP2 3008/4885EPHX1 2139/4885

“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.