SCHEMBL7064924

SCHEMBL7064924

COC(=O)c1ccc(C(=O)O)c(Cc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 2/20 0.39
HPGD P15428 1/20 0.39
KDM4E B2RXH2 3/20 0.39
AR P10275 1/20 0.38
TSHR P16473 1/20 0.38
RNASEH1 O60930 1/20 0.38
PKM P14618 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL8831581 0.85 ALDH1A1 (0.41) ALDH1A1LMNAMAPTMAPK1GAA
SCHEMBL29200833 0.79 ALDH1A1 (0.41) ALDH1A1LMNAMAPTGAAMEN1
SCHEMBL11703291 0.79 MAPT (0.47) ALDH1A1LMNAMAPTGAAMEN1
SCHEMBL6551228 0.78 TSHR (0.56) ALDH1A1LMNAMAPTMAPK1MEN1
SCHEMBL9089876 0.78 LMNA (0.40) ALDH1A1LMNAMAPTMAPK1MEN1
SCHEMBL7064920 0.78 ALDH1A1 (0.46) ALDH1A1LMNAMAPTMAPK1GAA
SCHEMBL9087027 0.77 ALDH1A1 (0.60) ALDH1A1LMNAMAPTMAPK1MEN1
SCHEMBL9460792 0.76 TSHR (0.53) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL9086781 0.74 ALDH1A1 (0.50) ALDH1A1LMNAMAPTMAPK1GAA
SCHEMBL27862571 0.74 TSHR (0.50) ALDH1A1MAPTGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313696-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-05-28 EP disclosed
US-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors ABBOTT LABORATORIES 2002-03-21 US disclosed
WO-2002018323-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2002-03-07 WO 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-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors PPM1A, PTPRO, PTP4A1 ALDH1A1 299/4885LMNA 4772/4885MAPT 2431/4885

“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.