SCHEMBL6835320

SCHEMBL6835320

CN1c2ccc(C(=O)O)cc2C(=O)C(Cc2ccccc2)[S+]1[O-]

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.46
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 2/20 0.37
TTR P02766 1/20 0.37
ALOX15 P16050 1/20 0.36
PTPRC P08575 2/20 0.36

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
SCHEMBL6835396 0.90 MRGPRX4 (0.37) PARK7KMT2AHPGDMEN1KDM4E
SCHEMBL6831719 0.89 NR4A2 (0.39) PARK7KMT2AHPGDMEN1NR1H2
SCHEMBL6835323 0.89 RXRA (0.39) PARK7KMT2AHPGDMEN1ALDH1A1
SCHEMBL6669286 0.87 ALDH1A1 (0.54) KMT2AHPGDMEN1L3MBTL1ALDH1A1
SCHEMBL6831808 0.86 HTR7 (0.36) PARK7NR1H2NR1H3L3MBTL1KDM4E
SCHEMBL6831758 0.86 TSHR (0.39) PARK7NR1H2NR1H3KDM4EPOLB
SCHEMBL6835226 0.83 KDM5A (0.36) PARK7
SCHEMBL6681605 0.81 DRD2 (0.49) KMT2AMEN1ALDH1A1POLB
SCHEMBL6678968 0.75 NR1H2 (0.49) PARK7KMT2AHPGDMEN1NR1H2
SCHEMBL6835596 0.75 DRD2 (0.45) KMT2AMEN1ALDH1A1

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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors HICKS JAMES LESTER (US) 2004-03-04 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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors MMP13, MMP26, MMP9 PARK7 639/4885KMT2A 2806/4885HPGD 564/4885

“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.