SCHEMBL6878595

SCHEMBL6878595

CCOC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(-c3ccc(-c4ccc(C(C)=O)cc4)cc3)cs2)CC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 3/20 0.55
GNRHR P30968 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK14 Q16539 11/20 0.43
HDAC4 P56524 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
HSPB1 P04792 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK11 Q15759 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
SCHEMBL6878598 1.00 MMP12 (0.55) MMP12GNRHRMEN1KMT2AMAPK14
SCHEMBL6882179 0.90 MMP12 (0.57) MMP12GNRHRMEN1KMT2AMAPK14
SCHEMBL6882247 0.89 MMP12 (0.56) MMP12GNRHRMEN1KMT2AMAPK14
SCHEMBL6874296 0.87 MMP12 (0.68) MMP12MAPK14HDAC4HDAC6HDAC3
SCHEMBL6452267 0.87 MMP12 (0.68) MMP12MAPK14HDAC4HDAC6HDAC3
SCHEMBL6370857 0.85 MMP12 (0.78) MMP12GNRHRMEN1KMT2AHDAC4
SCHEMBL6370860 0.85 MMP12 (0.78) MMP12GNRHRMEN1KMT2AHDAC4
SCHEMBL6450858 0.83 HDAC6 (0.57) MMP12MEN1KMT2AMAPK14HDAC4
SCHEMBL6394230 0.83 MMP12 (0.78) MMP12GNRHRMEN1KMT2AMAPK14
SCHEMBL6394228 0.83 MMP12 (0.78) MMP12GNRHRMEN1KMT2AMAPK14

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 7/4885GNRHR 775/4885MEN1 4862/4885

“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.