SCHEMBL155283

SCHEMBL155283

CCCCc1ccc(N)cc1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.43
ALDH1A1 P00352 6/20 0.42
TDP1 Q9NUW8 5/20 0.42
MAPT P10636 3/20 0.42
RECQL P46063 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
CASP6 P55212 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ELAVL1 Q15717 1/20 0.42
HSD17B10 Q99714 4/20 0.42
TYR P14679 2/20 0.41
NSD2 O96028 1/20 0.41
APEX1 P27695 1/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
GABRP O00591 1/20 0.37

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
SCHEMBL157232 0.94 MAPT (0.44) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL156572 0.94 MAPT (0.44) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL156404 0.94 MAPT (0.44) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL10799496 0.90 RAPGEF4 (0.45) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL27452004 0.87 RAPGEF4 (0.40) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL6427620 0.86 RAPGEF4 (0.50) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL29963180 0.86 RAPGEF4 (0.50) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL11479053 0.85 RAPGEF4 (0.44) RAPGEF4ALDH1A1TDP1MAPTRECQL
SCHEMBL27693512 0.85 CA2 (0.45) ALDH1A1TDP1MAPTL3MBTL1KDM4E
SCHEMBL157161 0.84 RAPGEF4 (0.49) RAPGEF4ALDH1A1TDP1MAPTRECQL

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-20120056931-A1 MAGENTA COLORING MATTER, INK COMPOSITION, AND COLORED BODY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-03-08 US disclosed