SCHEMBL6874296

SCHEMBL6874296

CC(=O)c1ccc(-c2ccc(-c3csc(C(=O)NC[C@H]4CC[C@H](C(=O)O)CC4)c3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 8/20 0.68
HDAC4 P56524 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
MAPK14 Q16539 8/20 0.44

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
SCHEMBL6452267 1.00 MMP12 (0.68) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6450858 0.88 HDAC6 (0.57) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6456462 0.88 MMP12 (0.72) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6878595 0.87 MMP12 (0.55) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6878598 0.87 MMP12 (0.55) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6455095 0.87 MMP12 (0.71) MMP12HDAC4HDAC6HDAC3HDAC1
Hydrochloric Acid SCHEMBL6881474 0.86 MMP12 (0.70) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6370030 0.81 MMP12 (1.00) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6370033 0.81 MMP12 (1.00) MMP12HDAC4HDAC6HDAC3HDAC1
SCHEMBL6879815 0.81 MMP12 (1.00) MMP12HDAC4HDAC6HDAC3HDAC1

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 7/4885HDAC4 484/4885HDAC6 611/4885

“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.