SCHEMBL30800673

SCHEMBL30800673

Cc1cc(=O)oc2ccc(S(=O)(=O)O)cc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.55
ALDH1A1 P00352 13/20 0.54
KDM4E B2RXH2 11/20 0.54
HPGD P15428 8/20 0.54
HSD17B10 Q99714 5/20 0.54
MCL1 Q07820 4/20 0.51
AKR1B1 P15121 2/20 0.51
CYP3A4 P08684 1/20 0.51
THRB P10828 1/20 0.51
MAOA P21397 1/20 0.49
GAA P10253 4/20 0.49
CYP1A2 P05177 2/20 0.49
CA12 O43570 2/20 0.49
GLA P06280 2/20 0.49
CASP1 P29466 2/20 0.49
CASP7 P55210 2/20 0.49
CA9 Q16790 2/20 0.49
LMNA P02545 1/20 0.49
CYP2C9 P11712 1/20 0.49
UGT1A1 P22309 1/20 0.49

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
SCHEMBL6522524 0.79 L3MBTL1 (0.56) ALDH1A1KDM4EHPGDHSD17B10AKR1B1
SCHEMBL6023766 0.77 MCL1 (0.55) ALDH1A1KDM4EHPGDHSD17B10MCL1
Sulfuric Acid SCHEMBL28442474 0.77 MAOA (0.64) STSALDH1A1KDM4EHPGDHSD17B10
SCHEMBL12313445 0.77 L3MBTL1 (0.47) ALDH1A1KDM4EKMT2A
SCHEMBL14588431 0.77 HPGD (0.45) ALDH1A1KDM4EHPGDGAALMNA
SCHEMBL9499154 0.76 AKR1B1 (0.43) ALDH1A1KDM4EHPGDHSD17B10AKR1B1
SCHEMBL128001 0.76 KDM4E (0.74) STSALDH1A1KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL9870305 0.76 AKR1B1 (0.51) ALDH1A1KDM4EHPGDHSD17B10AKR1B1
SCHEMBL5865936 0.76 MCL1 (0.54) ALDH1A1KDM4EHPGDHSD17B10MCL1
SCHEMBL67818 0.75 ALDH1A1 (0.64) STSALDH1A1KDM4EHPGDHSD17B10

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
CN-117769603-A Method for detecting microorganisms by direct addition of fluorescent dye to solid growth medium 迪亚米德克斯公司 2024-03-26 CN disclosed