SCHEMBL3084604

SCHEMBL3084604

CCN(CC)C(=O)C(CCCc1ccc(NC(=O)c2ccccc2)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
GPR27 Q9NS67 1/20 0.43
TRPV1 Q8NER1 2/20 0.43
LARS1 Q9P2J5 1/20 0.43
PPARA Q07869 3/20 0.42
KAT6A Q92794 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NR1H4 Q96RI1 1/20 0.41
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
HDAC1 Q13547 1/20 0.40
BMP1 P13497 1/20 0.40
MMP9 P14780 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
SCHEMBL3091266 0.96 LMNA (0.44) LMNAGPR27TRPV1LARS1PPARA
SCHEMBL15000148 0.90 LARS1 (0.45) LMNALARS1KDM4EMAPK1SMN1; SMN2
SCHEMBL3093901 0.90 MMP9 (0.46) LMNAGPR27LARS1PPARAKAT6A
SCHEMBL3102970 0.90 MMP9 (0.46) LMNAGPR27LARS1PPARAKAT6A
SCHEMBL3093062 0.88 NPC1 (0.48) LMNALARS1KDM4EMAPK1SMN1; SMN2
SCHEMBL14999964 0.86 KAT6A (0.47) LARS1KAT6AKDM4E
SCHEMBL15000037 0.86 LARS1 (0.49) LMNALARS1KDM4E
SCHEMBL3089105 0.85 LARS1 (0.40) LMNALARS1KAT6AKDM4E
SCHEMBL3088704 0.85 LARS1 (0.40) LMNAGPR27LARS1KAT6AKDM4E
SCHEMBL3090792 0.84 NPC1 (0.51) LMNAGPR27LARS1KAT6ANR1H4

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 LMNA 3803/4885GPR27 141/4885TRPV1 438/4885

“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.