SCHEMBL13261834

SCHEMBL13261834

CCOC(=O)C(C(=O)c1ccc(CS(=O)O)cc1)c1ccc(C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 1/20 0.38
▸ LMNA P02545 3/20 0.37
▸ GAA P10253 3/20 0.37
▸ RECQL P46063 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SLC6A3 Q01959 3/20 0.36
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36

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
SCHEMBL13261655 0.90 MMP8 (0.39) MMP8LMNAGAARECQLKDM4E
SCHEMBL13261650 0.90 EPHX2 (0.41) MMP8LMNAKDM4EMAPTHPGD
SCHEMBL13261549 0.89 CA12 (0.43) LMNAKDM4EMAPTHPGDALOX15
SCHEMBL13261548 0.89 TSHR (0.42) LMNAGAATP53MAPTHPGD
SCHEMBL13261550 0.89 MMP8 (0.35) MMP8LMNAGAARECQLKDM4E
SCHEMBL13261591 0.88 NAMPT (0.39) MMP8LMNAGAAKDM4EMAPT
SCHEMBL13261809 0.87 KMT2A (0.41) MMP8LMNAKDM4EHSD17B10CYP3A4
SCHEMBL13261547 0.87 POLB (0.40) LMNAGAATP53MAPTNPSR1
SCHEMBL13228057 0.86 MMP8 (0.47) MMP8LMNAGAAHPGDCYP1A2
SCHEMBL13261557 0.86 SMN1; SMN2 (0.43) LMNATP53MAPTHPGDMAPK1

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 4506/4885GAA 2128/4885

“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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