SCHEMBL3092116

SCHEMBL3092116

CC(C)N(C(=O)C(CC1CC1)C(=O)NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARS1 P26639 1/20 0.48
BCL2L1 Q07817 4/20 0.47
MCL1 Q07820 4/20 0.47
FFAR1 O14842 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
MMP9 P14780 4/20 0.41
MMP2 P08253 4/20 0.41
MMP13 P45452 4/20 0.41
MMP1 P03956 3/20 0.41
MMP3 P08254 2/20 0.41
NR3C1 P04150 1/20 0.41
MMP7 P09237 1/20 0.41
LMNA P02545 1/20 0.41
NPY5R Q15761 1/20 0.40
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
MMP16 P51512 1/20 0.39
ADAM17 P78536 1/20 0.39
ADAMTS4 O75173 1/20 0.39
PTGES O14684 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
SCHEMBL3097794 0.91 BCL2L1 (0.41) BCL2L1MCL1MMP9MMP2MMP13
SCHEMBL3083883 0.90 EGFR (0.48) MMP9MMP2MMP13MMP8
SCHEMBL3087959 0.88 EGFR (0.45) LMNA
SCHEMBL3092907 0.87 USP30 (0.41)
SCHEMBL3092840 0.87 EGFR (0.44) MMP2MMP13MMP1MMP3LMNA
SCHEMBL3092864 0.86 LARS1 (0.48) LMNANPY5R
SCHEMBL3089589 0.85 USP30 (0.42)
SCHEMBL3096770 0.85 EGFR (0.39) LMNA
SCHEMBL3091920 0.83 CCR5 (0.39) BCL2L1MCL1
SCHEMBL3097806 0.82 FBP1 (0.36)

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 TARS1 736/4885BCL2L1 3351/4885MCL1 4465/4885

“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.