SCHEMBL8596219

SCHEMBL8596219

O=C(O)CCNC(=O)c1cc(O)no1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.50
▸ LMNA P02545 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ SIRT5 Q9NXA8 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ EGLN2 Q96KS0 4/20 0.38
▸ EGLN1 Q9GZT9 2/20 0.38
▸ NME4 O00746 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ AVPR2 P30518 1/20 0.37
▸ AGTR1 P30556 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ AVPR1A P37288 1/20 0.37

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
SCHEMBL8532598 0.80 POLB (0.54) POLBLMNAKDM4EALDH1A1HPGD
SCHEMBL13766686 0.78 POLB (0.51) POLBLMNAL3MBTL1KDM4EALDH1A1
SCHEMBL8595599 0.78 POLB (0.48) POLBLMNAKDM4EALDH1A1HPGD
SCHEMBL17652550 0.78 MEN1 (0.55) LMNAL3MBTL1SIRT5KDM4EALDH1A1
SCHEMBL195378 0.75 POLB (0.68) POLBLMNAL3MBTL1KDM4EALDH1A1
SCHEMBL17652564 0.75 RAB9A (0.58) LMNAL3MBTL1SIRT5KDM4EALDH1A1
SCHEMBL9819478 0.74 FABP4 (0.54) POLBLMNAKDM4EALDH1A1HPGD
SCHEMBL9819468 0.74 LMNA (0.47) POLBLMNAL3MBTL1KDM4EALDH1A1
SCHEMBL9819406 0.73 LMNA (0.46) POLBLMNAL3MBTL1KDM4EALDH1A1
SCHEMBL14500985 0.71 CYP2C19 (0.60) LMNAKDM4EALDH1A1

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
WO-2012065958-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-24 — — WO disclosed
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors NOVARTIS AG (CH) 2010-12-02 — — 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-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors MME, AGTR1, REN POLB 2845/4885LMNA 635/4885L3MBTL1 3565/4885

“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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