SCHEMBL157231

SCHEMBL157231

CCCCCCCCc1ccc([NH])cc1S(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 1/20 0.39
LIPG Q9Y5X9 1/20 0.38
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36
KAT8 Q9H7Z6 2/20 0.36

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
SCHEMBL156571 1.00 TYR (0.44) TYRTSHRMEN1KMT2ATP53
SCHEMBL156403 1.00 TYR (0.44) TYRTSHRMEN1KMT2ATP53
SCHEMBL155282 0.94 TYR (0.41) TYRTSHRMEN1KMT2ATP53
SCHEMBL158548 0.88 MEN1 (0.41) TYRTSHRMEN1KMT2ATP53
SCHEMBL29405900 0.83 KAT8 (0.47) TYRTSHRMEN1KMT2ATP53
SCHEMBL9139426 0.83 KAT8 (0.47) TYRTSHRMEN1KMT2ATP53
SCHEMBL16341724 0.83 KAT8 (0.47) TYRTSHRMEN1KMT2ATP53
SCHEMBL157160 0.82 HPGD (0.38) TSHRMEN1KMT2AMAPTALDH1A1
SCHEMBL156404 0.82 MAPT (0.44) TYRTSHRMEN1KMT2ATP53
SCHEMBL156572 0.82 MAPT (0.44) TYRTSHRMEN1KMT2ATP53

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