SCHEMBL6848742

SCHEMBL6848742

NCC(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAPGEF3 O95398 2/20 0.59
LARS1 Q9P2J5 1/20 0.58
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
KAT6A Q92794 4/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
F2 P00734 2/20 0.54
PRSS1 P07477 2/20 0.54
PRSS2 P07478 2/20 0.54
PRSS3 P35030 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HTT P42858 1/20 0.54
LMNA P02545 2/20 0.53
SLC1A3 P43003 1/20 0.51
SLC1A2 P43004 1/20 0.51
SLC1A1 P43005 1/20 0.51
CTSS P25774 1/20 0.51

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
SCHEMBL3267161 0.82 F2 (0.62) RAPGEF3LARS1CA2KAT6AL3MBTL1
SCHEMBL24483721 0.82 ALDH1A1 (0.64) RAPGEF3LARS1KAT6AL3MBTL1ALDH1A1
SCHEMBL11032473 0.82 L3MBTL1 (0.62) RAPGEF3LARS1KAT6AL3MBTL1F2
SCHEMBL23843539 0.81 RAPGEF3 (0.85) RAPGEF3ALDH1A1HTTLMNA
SCHEMBL21447728 0.81 RAPGEF3 (0.58) RAPGEF3LARS1KAT6AL3MBTL1ALDH1A1
SCHEMBL24481892 0.81 RAPGEF3 (0.58) RAPGEF3LARS1KAT6AL3MBTL1ALDH1A1
SCHEMBL7774671 0.80 L3MBTL1 (0.61) RAPGEF3LARS1KAT6AL3MBTL1F2
SCHEMBL3928657 0.80 CA1 (0.67) LARS1CA1CA2KAT6ALMNA
SCHEMBL15633648 0.80 RAPGEF3 (0.54) RAPGEF3LARS1KAT6AL3MBTL1F2
SCHEMBL3267159 0.79 L3MBTL1 (0.59) RAPGEF3LARS1KAT6AL3MBTL1F2

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-6774212-B2 FOR THERAPY OF VIRAL INFECTION OR AS AN ASSAY STANDARD OR REAGENT BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-08-10 US disclosed