SCHEMBL11035965

SCHEMBL11035965

CCCCCCCCCCCCc1ccc(S(=O)(=O)O)cc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.63
HTT P42858 4/20 0.63
KMT2A Q03164 4/20 0.63
TYR P14679 3/20 0.63
MAPT P10636 2/20 0.63
TP53 P04637 1/20 0.63
CYP3A4 P08684 1/20 0.63
ALOX5 P09917 1/20 0.63
ALOX15 P16050 1/20 0.63
TSHR P16473 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
SERPINE1 P05121 1/20 0.49
S1PR3 Q99500 1/20 0.48
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
ATM Q13315 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 2/20 0.46

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
SCHEMBL11782647 0.97 MEN1 (0.58) MEN1HTTKMT2ATYRMAPT
SCHEMBL3680212 0.89 S1PR3 (0.49) MEN1HTTKMT2ATYRMAPT
SCHEMBL31513533 0.89 S1PR3 (0.49) MEN1HTTKMT2ATYRMAPT
SCHEMBL2244969 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL2252169 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL2243909 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL2244288 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL2246618 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL2247353 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT
SCHEMBL6968757 0.88 CA2 (0.52) MEN1HTTKMT2ATYRMAPT

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
JP-59187344-A None JP disclosed
JP-S59187344-A MANUFACTURE OF OFFSET PRINTING PLATE MITSUBISHI PAPER MILLS LTD 1984-10-24 JP disclosed