SCHEMBL6874175

SCHEMBL6874175

O=C(O)CCc1ccc(CNC(=O)c2cc(-c3ccc(OC(F)(F)F)cc3)cs2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 7/20 0.57
MMP13 P45452 1/20 0.53
MAPK1 P28482 1/20 0.48
PPARA Q07869 5/20 0.48
EPHX2 P34913 3/20 0.48
PPARG P37231 2/20 0.48
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 2/20 0.48
NR1H4 Q96RI1 1/20 0.46
HTR2C P28335 1/20 0.45
PPARD Q03181 2/20 0.45
RORC P51449 1/20 0.44
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43

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
SCHEMBL6874004 0.91 MMP12 (0.55) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6456507 0.90 MMP12 (0.72) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6462719 0.88 MMP12 (0.64) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6450855 0.88 MMP12 (0.55) MMP12MMP13EPHX2FFAR1FFAR4
SCHEMBL6663858 0.88 MMP12 (0.59) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6875530 0.88 MMP12 (0.58) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL8337355 0.84 MMP12 (0.60) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6450465 0.83 MMP12 (0.62) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6881373 0.82 MMP12 (0.55) MMP12MMP13MAPK1PPARAEPHX2
SCHEMBL6667161 0.82 MMP12 (0.60) MMP12MMP13MAPK1PPARAEPHX2

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
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 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 7/4885MMP13 2/4885MAPK1 2663/4885

“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.