SCHEMBL13228083

SCHEMBL13228083

CCOC(=O)C(C(=O)c1ccc(C)cc1)c1cc(C)cc(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ SLC6A3 Q01959 3/20 0.38
▸ SLC6A4 P31645 3/20 0.38
▸ SLC6A2 P23975 2/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA7 P43166 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA14 Q9ULX7 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL13228057 0.89 MMP8 (0.47) MMP8LMNAKMT2ACYP1A2MEN1
SCHEMBL2511176 0.87 MMP8 (0.44) MMP8LMNAKMT2ACYP1A2MEN1
SCHEMBL3796823 0.86 GAA (0.40) KMT2AGAACA12CA1CA2
SCHEMBL7092555 0.84 MMP8 (0.59) MMP8LMNAKMT2ACYP1A2MEN1
SCHEMBL13261550 0.84 MMP8 (0.35) MMP8LMNACYP1A2CYP3A4MAOA
SCHEMBL13228049 0.82 MMP8 (0.46) MMP8LMNAKMT2AMEN1GAA
SCHEMBL13228075 0.82 NAMPT (0.44) MMP8LMNAKMT2AMEN1CYP3A4
SCHEMBL13228080 0.82 LMNA (0.47) MMP8LMNAKMT2ACYP1A2MEN1
SCHEMBL7090828 0.82 L3MBTL1 (0.52) MMP8LMNAKMT2AMAOAGAA
SCHEMBL13228101 0.81 CES2 (0.46) MMP8LMNAKMT2AMEN1GAA

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-7781592-B2 Thione derivative, method for the preparation thereof, and pharmaceutical composition containing the same CJ CHEILJEDANG CORPORATION (KR) 2010-08-24 — — US disclosed
US-20080090875-A1 Thione Derivative, Method For The Preparation Thereof, And Pharmaceutical Composition Containing The Same CJC CORPORATION (KR) 2008-04-17 — — 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-20080090875-A1 Thione Derivative, Method For The Preparation Thereof, And Pharmaceutical Composition Containing The Same TPMT, TST, CYP3A5 MMP8 3178/4885LMNA 4506/4885KMT2A 3602/4885

“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.

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