SCHEMBL3090735

SCHEMBL3090735

CCN(CC)C(=O)C(Cc1ccc(NC(=O)C(C)C)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.48
LARS1 Q9P2J5 1/20 0.48
NLRP3 Q96P20 1/20 0.42
PLG P00747 2/20 0.41
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
F10 P00742 1/20 0.40
PLAT P00750 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL14999932 0.91 LARS1 (0.47) F2LARS1NLRP3NPSR1
SCHEMBL3090331 0.91 LARS1 (0.47) F2LARS1KDM4EMEN1MAPT
SCHEMBL14999923 0.91 MAPT (0.46) F2LARS1NLRP3KDM4EMEN1
SCHEMBL13151776 0.89 LARS1 (0.48) F2LARS1PLGF10PLAT
SCHEMBL18387952 0.89 LARS1 (0.48) F2LARS1PLGF10PLAT
SCHEMBL3093901 0.89 MMP9 (0.46) F2LARS1PLGMEN1KMT2A
SCHEMBL3090750 0.89 LARS1 (0.45) F2LARS1NLRP3KDM4EMAPT
SCHEMBL3102970 0.89 MMP9 (0.46) F2LARS1PLGMEN1KMT2A
SCHEMBL14999933 0.89 LARS1 (0.47) F2LARS1PLGNPSR1
SCHEMBL3096834 0.88 LARS1 (0.44) F2LARS1NLRP3PLGF10

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-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

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 F2 4128/4885LARS1 1976/4885NLRP3 1883/4885

“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.