SCHEMBL14999902

SCHEMBL14999902

CCN(CC)C(=O)[C@H](Cc1ccc(N)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 1/20 0.52
F2 P00734 9/20 0.49
ALDH1A1 P00352 2/20 0.43
PLG P00747 2/20 0.42
F10 P00742 1/20 0.42
PLAT P00750 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL3101150 1.00 LARS1 (0.52) LARS1F2ALDH1A1PLGF10
SCHEMBL15000276 0.92 LARS1 (0.53) LARS1F2ALDH1A1PLGKDM4E
SCHEMBL3085973 0.92 LARS1 (0.53) LARS1F2ALDH1A1PLGKDM4E
SCHEMBL3093732 0.91 LARS1 (0.44) LARS1F2ALDH1A1PLGF10
SCHEMBL13152388 0.91 LARS1 (0.50) LARS1F2ALDH1A1
SCHEMBL18383338 0.91 LARS1 (0.50) LARS1F2ALDH1A1
SCHEMBL18387777 0.91 LARS1 (0.50) LARS1F2KMT2A
SCHEMBL15000058 0.90 LARS1 (0.50) LARS1F2PLGF10PLAT
SCHEMBL15000268 0.90 LARS1 (0.50) LARS1F2ALDH1A1KDM4EKMT2A
SCHEMBL15000247 0.90 LARS1 (0.49) LARS1F2F10

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 1 patent. 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