SCHEMBL9197679

SCHEMBL9197679

Cc1ccc(S(=O)(=O)Oc2cc(C=O)cc(OS(=O)(=O)c3ccc(C)cc3)c2OS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.55
GFER P55789 1/20 0.51
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
LMNA P02545 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
MAPT P10636 4/20 0.50
HTT P42858 3/20 0.50
GAA P10253 4/20 0.49
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPK1 P28482 3/20 0.46
HPGD P15428 3/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
PKM P14618 2/20 0.44
NPSR1 Q6W5P4 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
SCHEMBL12119951 0.87 GFER (0.52) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL31013906 0.86 GFER (0.50) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL9155140 0.84 GFER (0.61) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL9197684 0.81 ALDH1A1 (0.50) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL21993216 0.81 GFER (0.58) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL1935202 0.81 HPGD (0.67) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL1936658 0.81 GFER (0.72) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL15631695 0.80 GFER (0.53) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL64533 0.78 KMT2A (0.62) ALDH1A1GFERMEN1KMT2ALMNA
SCHEMBL13435291 0.77 GFER (0.51) ALDH1A1GFERMEN1KMT2ALMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510445-B1 Acid-cleavable radiation-sensitive compounds, radiation-sensitive composition containing the same and radiation-sensitive recording material prepared therefrom HOECHST AG (DE) 1995-08-09 EP disclosed
US-5346804-A Acid-cleavable radiation-sensitive compounds, positive working radiation-sensitive mixture containing theses compounds, and radiation-sensitive recording material produced with this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1994-09-13 US disclosed
EP-0510445-A1 Acid-cleavable radiation-sensitive compounds, radiation-sensitive composition containing the same and radiation-sensitive recording material prepared therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1992-10-28 EP disclosed