SCHEMBL16232067

SCHEMBL16232067

CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 9/20 0.59
▸ ACE P12821 8/20 0.59
▸ SRR Q9GZT4 1/20 0.47
▸ PSAT1 Q9Y617 1/20 0.47

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
SCHEMBL16232066 0.88 MME (0.53) MMEACE
SCHEMBL18970022 0.86 REN (0.48) MMEACESRRPSAT1
SCHEMBL28586322 0.86 MME (0.56) MMEACESRRPSAT1
SCHEMBL28632127 0.86 MME (0.56) MMEACESRRPSAT1
SCHEMBL28586326 0.86 MME (0.56) MMEACESRRPSAT1
SCHEMBL24404055 0.84 GPR88 (0.49) MMEACESRRPSAT1
SCHEMBL609953 0.84 GPR88 (0.49) MMEACESRRPSAT1
SCHEMBL21572784 0.84 GPR88 (0.49) MMEACESRRPSAT1
SCHEMBL598890 0.84 GPR88 (0.49) MMEACESRRPSAT1
SCHEMBL18059571 0.84 GPR88 (0.49) MMEACESRRPSAT1

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-20140336194-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2014-11-13 — — US disclosed
US-20140336194-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2014-11-13 — — 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-20140336194-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY REN, SERPINB1, MME MME 3/4885ACE 92/4885SRR 495/4885

“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.

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