SCHEMBL3085601

SCHEMBL3085601

CCOC(=O)C(Cc1coc(-c2ccc(F)cc2)n1)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
GAA P10253 2/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.46
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
PDE4B Q07343 1/20 0.41

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
SCHEMBL2817919 0.81 LMNA (0.57) LMNAGAATSHRKMT2AHPGD
SCHEMBL2224129 0.79 LMNA (0.49) LMNAGAATSHRKMT2AHPGD
SCHEMBL13153218 0.76 LMNA (0.49) LMNAGAATSHRKMT2AHPGD
SCHEMBL2817924 0.76 HDAC1 (0.58) LMNAGAAKMT2AHPGDHDAC1
SCHEMBL14294336 0.74 LMNA (0.52) LMNAGAATSHRKMT2AHPGD
SCHEMBL3102952 0.72 MAPT (0.49) LMNAGAAKMT2AHPGD
SCHEMBL2223461 0.71 LMNA (0.54) LMNAGAATSHRKMT2AHPGD
SCHEMBL2224843 0.71 LMNA (0.59) LMNAGAATSHRKMT2AHPGD
SCHEMBL4907387 0.71 PPARG (0.50) KMT2A
SCHEMBL12445017 0.70 LMNA (0.49) LMNAGAATSHRKMT2AHPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2172450-B9 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2014-10-08 EP disclosed
EP-2172450-B1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2013-10-16 EP disclosed
US-8461209-B2 Malonic acid sulfonamide derivative and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-06-11 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 US disclosed
EP-2172450-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2010-04-07 EP 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-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 LMNA 3803/4885GAA 272/4885TSHR 678/4885

“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.