SCHEMBL31541813

SCHEMBL31541813

C#Cc1ccccc1S(=O)(=O)OCC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 11/20 0.37
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ RORC P51449 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.30
▸ HSD11B1 P28845 1/20 0.30

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
SCHEMBL777419 0.83 CA2 (0.45) SLC22A12CA1CA2CA9MEN1
SCHEMBL11090400 0.76 GAA (0.47) CA1CA2CA9MEN1KMT2A
SCHEMBL2354799 0.76 HSD11B1 (0.41) CA1CA2CA9MEN1KMT2A
SCHEMBL11086064 0.73 CA1 (0.33) CA1CA2CA9
SCHEMBL11092915 0.72 KMT2A (0.54) CA1CA2MEN1KMT2A
SCHEMBL2270234 0.71 CA1 (0.43) CA1CA2CA9KMT2ARORC
SCHEMBL31541853 0.69 MAPT (0.36) KMT2A
SCHEMBL29449482 0.68 MEN1 (0.50) SLC22A12MEN1KMT2ARXFP1HSD11B1
SCHEMBL6115152 0.68 MEN1 (0.50) SLC22A12MEN1KMT2ARXFP1HSD11B1
SCHEMBL31541822 0.67 CA12 (0.35) CA2CA9

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
WO-2025062119-A2 NEW COMPOUNDS AND USES THEREOF IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2025-03-27 — — WO disclosed
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