SCHEMBL3103314

SCHEMBL3103314

CC(C)N(C(=O)C(CC1CC1)C(=O)NS(=O)(=O)Cc1ccccc1)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.40
OPRM1 P35372 2/20 0.39
KMT2A Q03164 2/20 0.39
CTSL P07711 1/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CCKAR P32238 1/20 0.36
CCKBR P32239 1/20 0.36
HTR7 P34969 1/20 0.36
STS P08842 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
BACE1 P56817 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL3088024 0.90 OPRM1 (0.38) TAS2R14OPRM1KMT2ACTSLKDM4E
SCHEMBL3099793 0.86 MEN1 (0.35) KMT2ACTSLCCKARCCKBRHTR7
SCHEMBL3100054 0.85 CTSL (0.36) OPRM1KMT2ACTSLHSD17B10HTR7
SCHEMBL3103766 0.83 CTSL (0.35) OPRM1KMT2ACTSL
SCHEMBL3090474 0.83 CTSL (0.35) OPRM1CTSLHTR7
SCHEMBL3097794 0.83 BCL2L1 (0.41) KMT2ACTSLMEN1
SCHEMBL3087951 0.82 KMT2A (0.40) OPRM1KMT2ACTSLALDH1A1MEN1
SCHEMBL3093486 0.82 CTSL (0.34) CTSLHTR7
SCHEMBL3092116 0.81 TARS1 (0.48)
SCHEMBL3093425 0.81 CTSL (0.41) OPRM1KMT2ACTSLCCKARCCKBR

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 TAS2R14 1309/4885OPRM1 2431/4885KMT2A 1948/4885

“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.