SCHEMBL6875476

SCHEMBL6875476

CC(=O)c1ccc(-c2ccc(-c3csc(C(=O)NCc4ccc(CC(=O)O)cc4)c3)cc2)cc1O

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 6/20 0.71
EGLN1 Q9GZT9 1/20 0.41
NR1H4 Q96RI1 3/20 0.40
EGFR P00533 1/20 0.40
EPHX2 P34913 1/20 0.40
RXRA P19793 2/20 0.39
RXRB P28702 2/20 0.39
RXRG P48443 2/20 0.39
RORC P51449 1/20 0.39
MMP13 P45452 1/20 0.39
MAPK1 P28482 1/20 0.39
KLKB1 P03952 1/20 0.37
KLK1 P06870 1/20 0.37
FFAR1 O14842 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
SCHEMBL6873463 0.88 MMP12 (0.71) MMP12NR1H4EGFREPHX2RXRA
SCHEMBL6881333 0.87 MMP12 (0.53) MMP12EGLN1EGFRMMP13MAPK1
SCHEMBL6873364 0.84 MMP12 (0.74) MMP12NR1H4EGFREPHX2RXRA
SCHEMBL6461928 0.81 MMP12 (1.00) MMP12NR1H4EGFREPHX2RORC
SCHEMBL8341227 0.81 MMP12 (0.77) MMP12MMP13MAPK1
SCHEMBL8339276 0.80 MMP12 (0.75) MMP12NR1H4EPHX2RXRARXRB
SCHEMBL6880697 0.79 MMP12 (0.78) MMP12NR1H4EPHX2RXRARXRB
SCHEMBL8342537 0.78 MMP12 (0.77) MMP12NR1H4EPHX2RXRARXRB
SCHEMBL6874960 0.78 MMP12 (0.77) MMP12NR1H4EPHX2RXRARXRB
SCHEMBL6455151 0.78 MMP12 (0.66) MMP12NR1H4EPHX2RXRARXRB

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-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them WARNER-LAMBERT COMPANY LLC 2004-04-15 US claimed
WO-2004018448-A1 NOVEL THIOPHENE DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME WARNER-LAMBERT COMPANY LLC (US) 2004-03-04 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-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them MMP11, MMP13, CBR1 MMP12 7/4885EGLN1 2582/4885NR1H4 251/4885

“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.