SCHEMBL11075087

SCHEMBL11075087

C[n+]1cc(Br)cc2ccccc21.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 6/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HTT P42858 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ TERT O14746 2/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GAA P10253 1/20 0.32
▸ FGB P02675 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2A6 P11509 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
Trifluoromethanesulfonic Acid SCHEMBL23356582 0.78 MEN1 (0.38) TERTMEN1KMT2A
SCHEMBL11063962 0.76 KDM4E (0.43) RAPGEF4MAPTHTTNPSR1TDP1
SCHEMBL11933620 0.72 TERT (0.41) RAPGEF4MAPTHTTNPSR1TDP1
SCHEMBL20854534 0.71 RAPGEF4 (0.40) RAPGEF4MAPTHTTNPSR1TDP1
SCHEMBL20874147 0.71 RAPGEF4 (0.40) RAPGEF4NPSR1TDP1GAAPOLB
SCHEMBL1499866 0.69 RAPGEF4 (0.54) RAPGEF4MAPTNPSR1TDP1GAA
SCHEMBL9165326 0.69 RAPGEF4 (0.54) RAPGEF4NPSR1TDP1GAAPOLB
SCHEMBL6274955 0.69 RAPGEF4 (0.54) RAPGEF4NPSR1TDP1GAAPOLB
Potassium Ion SCHEMBL28668574 0.69 RAPGEF4 (0.54) RAPGEF4NPSR1TDP1GAAPOLB
Silver SCHEMBL9243729 0.69 RAPGEF4 (0.54) RAPGEF4NPSR1TDP1GAAPOLB

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
US-4431774-A QUINOLINIUM SULFONATES AS LATENT ACID CATALYSTS; RADIATION; DECOMPOSITION; STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1984-02-14 — — US disclosed
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