SCHEMBL9568629

SCHEMBL9568629

C=CC(=O)Nc1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 4/20 0.58
ALDH1A1 P00352 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
POLB P06746 1/20 0.51
DHX9 Q08211 1/20 0.50
HPGD P15428 1/20 0.49
EGFR P00533 2/20 0.47
GSTO1 P78417 1/20 0.47
BTK Q06187 1/20 0.46
LPAR1 Q92633 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46
KEAP1 Q14145 1/20 0.46
ITK Q08881 2/20 0.45
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL9568667 0.85 TGM2 (0.55) TGM2ALDH1A1HPGDEGFRGSTO1
SCHEMBL4103284 0.85 TGM2 (0.76) TGM2EGFRBTKLPAR1LPAR2
SCHEMBL9568638 0.83 TGM2 (0.70) TGM2ALDH1A1SMN1; SMN2HPGDGSTO1
SCHEMBL30595307 0.81 TGM2 (0.67) TGM2ALDH1A1SMN1; SMN2GSTO1
SCHEMBL9568677 0.81 TGM2 (0.58) TGM2ALDH1A1POLBHPGDBTK
SCHEMBL9568733 0.80 BTK (0.63) TGM2ALDH1A1SMN1; SMN2POLBBTK
SCHEMBL19329644 0.80 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2POLBDHX9HPGD
SCHEMBL22600367 0.80 TGM2 (0.65) TGM2EGFRBTKLPAR1LPAR2
SCHEMBL12136900 0.80 ALDH1A1 (0.70) ALDH1A1SMN1; SMN2POLBDHX9HPGD
SCHEMBL6355891 0.80 TGM2 (0.65) TGM2ALDH1A1SMN1; SMN2POLBEGFR

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
EP-0544264-A1 Light-sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1993-06-02 EP disclosed