SCHEMBL9568753

SCHEMBL9568753

C=CC(=O)Oc1ccccc1S(=O)(=O)NCCC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.53
CA9 Q16790 4/20 0.53
THRB P10828 3/20 0.49
THRA P10827 1/20 0.49
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
RECQL P46063 1/20 0.40
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2C9 P11712 1/20 0.38
ACLY P53396 1/20 0.38
TP53 P04637 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
FABP4 P15090 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL9568704 0.92 CA12 (0.55) CA12CA9THRBTHRAPOLB
SCHEMBL9568582 0.89 THRB (0.48) CA12CA9THRBTHRAALDH1A1
SCHEMBL3243625 0.83 CA12 (0.55) CA12CA9POLBL3MBTL1RECQL
SCHEMBL9568803 0.82 THRB (0.45) THRBTHRAL3MBTL1ACLYLMNA
SCHEMBL9568742 0.78 CASP1 (0.43) THRBTHRA
SCHEMBL3564486 0.77 L3MBTL1 (0.64) CA12CA9POLBL3MBTL1RECQL
SCHEMBL9568587 0.77 THRA (0.43) THRBTHRAPOLBALDH1A1CYP2C19
SCHEMBL9568797 0.77 ALDH1A1 (0.59) CA12CA9THRBPOLBL3MBTL1
SCHEMBL3242542 0.75 CA12 (0.56) CA12CA9POLBL3MBTL1RECQL
SCHEMBL29602140 0.75 THRB (0.46) THRBTHRAALDH1A1CYP2C19CYP2C9

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