SCHEMBL5139816

SCHEMBL5139816

[CH2]CC(=O)N(C)c1ccccc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTR6 P50406 1/20 0.37
MYC P01106 1/20 0.36
KMT2A Q03164 2/20 0.36
TTR P02766 1/20 0.34
CA9 Q16790 5/20 0.33
CA12 O43570 3/20 0.33
CYP1A2 P05177 2/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
POLB P06746 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
HIF1A Q16665 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL483013 0.81 TSHR (0.40) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL7826537 0.76 TRPM8 (0.45) ALDH1A1TSHRTP53MAPTHTT
SCHEMBL5139815 0.75 TSHR (0.38) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL6265807 0.75 HTR6 (0.60) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL28326313 0.73 HTR6 (0.58) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL7824932 0.72 TSPO (0.44) ALDH1A1SMN1; SMN2POLBL3MBTL1
SCHEMBL16896865 0.71 HTR6 (0.37) ALDH1A1TSHRTP53GAAMAPT
SCHEMBL1223078 0.70 MYC (0.41) ALDH1A1TSHRGAAMAPTSMN1; SMN2
SCHEMBL5139818 0.70 KMT2A (0.41) ALDH1A1TSHRTP53GAASMN1; SMN2
SCHEMBL483077 0.70 ALDH1A1 (0.33) ALDH1A1TSHRTP53GAAMAPT

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-7416835-B2 Polymerizable composition FUJIFILM CORPORATION (JP) 2008-08-26 US disclosed
US-20050106495-A1 Polymerizable composition FUJI PHOTO FILM CO., LTD. 2005-05-19 US disclosed