SCHEMBL6370604

SCHEMBL6370604

O=Cc1cc(-c2ccc(OC(F)(F)F)cc2)c(F)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 3/20 0.44
ALPI P09923 1/20 0.38
FFAR4 Q5NUL3 2/20 0.37
CHEK1 O14757 1/20 0.37
FFAR1 O14842 1/20 0.37
AURKA O14965 1/20 0.37
TPX2 Q9ULW0 1/20 0.37
KIF11 P52732 1/20 0.36
SCN5A Q14524 3/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
GPR3 P46089 1/20 0.35
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
NOTUM Q6P988 1/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35

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
SCHEMBL18917047 0.77 PRKDC (0.40) MMP12ALPIFFAR4CHEK1FFAR1
SCHEMBL6378030 0.75 MMP12 (0.59) MMP12FFAR4CHEK1FFAR1AURKA
SCHEMBL6142330 0.74 MMP12 (0.45) MMP12ALPIAURKATPX2KIF11
SCHEMBL1134037 0.74 ERCC5 (0.49) ALPICHEK1KIF11SCN5AHDAC6
SCHEMBL15104697 0.71 HDAC3 (0.44) ALPISCN5AHDAC6PIM1NOTUM
SCHEMBL18003877 0.71 SCN5A (0.44) MMP12ALPISCN5AF2RL3
SCHEMBL18002113 0.70 KIF11 (0.38) AURKATPX2KIF11SCN5AERCC5
SCHEMBL19769347 0.69 XDH (0.44) FFAR4FFAR1KIF11SCN5AGPR3
SCHEMBL12952695 0.69 KIF11 (0.40) FFAR4FFAR1AURKATPX2KIF11
SCHEMBL16844030 0.69 ALOX5AP (0.46) FFAR4FFAR1AURKATPX2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014817-A1 Fluorothiophene derivatives, process for preparing them and pharmaceutical compositions containing them PFIZER INC 2005-01-20 US disclosed
WO-2005003114-A1 5-FLUORO-THIOPEN-COMPOUNDS,THE PROCESS FOR THEIR PREPARATION,THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS METALLOPOTENASES INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2005-01-13 WO disclosed
WO-2005003114-A1 5-FLUORO-THIOPEN-COMPOUNDS,THE PROCESS FOR THEIR PREPARATION,THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS METALLOPOTENASES INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2005-01-13 WO disclosed
EP-1493740-A1 5-fluoro-thiophene compounds, the process for their prepartion, the pharmaceutical compositions containing them and their use as metalloproteinases inhibitors Warner-Lambert Company LLC (US) 2005-01-05 EP 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-20050014817-A1 Fluorothiophene derivatives, process for preparing them and pharmaceutical compositions containing them MMP12, MMP13, MMP11 MMP12 1/4885ALPI 486/4885FFAR4 1571/4885

“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.