SCHEMBL3083883

SCHEMBL3083883

COc1ccc(S(=O)(=O)NC(=O)C(CC2CC2)C(=O)N(c2ccc(F)cc2)C(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.48
ERBB2 P04626 1/20 0.48
TAS2R14 Q9NYV8 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
BMP1 P13497 1/20 0.40
POLB P06746 2/20 0.40
LTC4S Q16873 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 2/20 0.39
HTR7 P34969 2/20 0.39
MEN1 O00255 1/20 0.39
USP30 Q70CQ3 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP13 P45452 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
SCHEMBL3087959 0.90 EGFR (0.45) EGFRERBB2TAS2R14ALDH1A1GAA
SCHEMBL3092116 0.90 TARS1 (0.48) MMP2MMP9MMP8MMP13
SCHEMBL3092907 0.90 USP30 (0.41) EGFRERBB2LTC4SHTR7USP30
SCHEMBL3092840 0.89 EGFR (0.44) EGFRERBB2SMN1; SMN2ALDH1A1LTC4S
SCHEMBL3096770 0.88 EGFR (0.39) EGFRERBB2SMN1; SMN2ALDH1A1KMT2A
SCHEMBL3089589 0.88 USP30 (0.42) ALDH1A1MAPTUSP30
SCHEMBL3097794 0.88 BCL2L1 (0.41) KMT2AMEN1USP30MMP2MMP9
SCHEMBL3092864 0.85 LARS1 (0.48) SMN1; SMN2MAPTKMT2AHTR7MEN1
SCHEMBL3091920 0.85 CCR5 (0.39) USP30
SCHEMBL3097806 0.85 FBP1 (0.36) EGFRERBB2LTC4SUSP30

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 EGFR 346/4885ERBB2 781/4885TAS2R14 1309/4885

“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.