SCHEMBL10344242

SCHEMBL10344242

CCC(C)S(=O)(=O)c1cccc2cccc(N(C)C)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ TDP1 Q9NUW8 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ CA2 P00918 2/20 0.39
▸ HTR6 P50406 1/20 0.37
▸ F2 P00734 3/20 0.37
▸ PRSS1 P07477 3/20 0.37
▸ PRSS2 P07478 3/20 0.37
▸ PRSS3 P35030 3/20 0.37
▸ EDNRA P25101 8/20 0.35
▸ NSD2 O96028 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL13677633 0.84 MAPT (0.55) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL10048751 0.80 GAA (0.57) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL15764867 0.77 MAPT (0.46) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL14845761 0.76 GAA (0.61) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL8149846 0.76 CA2 (0.64) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL17807515 0.76 GAA (0.52) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL15075265 0.75 GAA (0.55) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL4889389 0.74 GAA (0.59) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL9676821 0.74 GAA (0.59) MAPTKDM4EGAATDP1L3MBTL1
SCHEMBL17322787 0.74 GAA (0.59) MAPTKDM4EGAATDP1L3MBTL1

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-20160160215-A1 POLYNUCLEOTIDES FOR MULTIVALENT RNA INTERFERENCE, COMPOSITIONS AND METHODS OF USE THEREOF HALO BIO RNAI THERAPEUTICS INC (US) 2016-06-09 — — US disclosed
WO-2012097091-A2 ENGINEERED MICROORGANISMS WITH ENHANCED FERMENTATION ACTIVITY VERDEZYNE, INC. (US) 2012-07-19 — — WO disclosed
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