SCHEMBL6884274

SCHEMBL6884274

COC(=O)CCC1CCC(NC(=O)c2cc(-c3ccc(OC(F)(F)F)cc3)cs2)CC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 8/20 0.58
MMP13 P45452 2/20 0.48
ABL1 P00519 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
EPHX2 P34913 3/20 0.41
FAAH O00519 1/20 0.41
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
TRPV1 Q8NER1 1/20 0.41
CYP2D6 P10635 1/20 0.41
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
DRD4 P21917 1/20 0.39
HTR2A P28223 1/20 0.39
FASN P49327 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39

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
SCHEMBL6879557 1.00 MMP12 (0.58) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6882754 0.91 MMP12 (0.53) MMP12MMP13ABL1EPHX2DRD2
SCHEMBL6882759 0.91 MMP12 (0.53) MMP12MMP13ABL1EPHX2DRD2
SCHEMBL6530340 0.90 MMP12 (0.63) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6882944 0.90 MMP12 (0.63) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6454253 0.88 MMP12 (0.62) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL8342799 0.86 MMP12 (0.59) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6879366 0.85 MMP12 (0.64) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6525522 0.85 MMP12 (0.64) MMP12MMP13ABL1L3MBTL1EPHX2
SCHEMBL6874089 0.85 MMP12 (0.57) MMP12MMP13ABL1L3MBTL1EPHX2

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 disclosed
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 7/4885MMP13 2/4885ABL1 2800/4885

“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.