SCHEMBL24846701

SCHEMBL24846701

O=C(Oc1c(F)c(F)c(S(=O)(=O)O)c(F)c1F)c1cccc(I)c1I

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA7 P43166 1/20 0.30
▸ CA13 Q8N1Q1 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
SCHEMBL22866012 0.81 POLB (0.33) —
SCHEMBL24021501 0.81 — —
SCHEMBL26816354 0.80 F2 (0.33) —
SCHEMBL24846704 0.79 HPGD (0.49) KMT2AALDH1A1CA12CA1CA2
SCHEMBL26938013 0.75 TTR (0.37) —
SCHEMBL13713552 0.74 TSHR (0.43) KMT2AALDH1A1CA12CA1CA2
SCHEMBL26037226 0.71 ACP1 (0.30) KMT2A
SCHEMBL15189428 0.71 PARP1 (0.41) ALDH1A1
SCHEMBL5889541 0.69 TSHR (0.47) KMT2AALDH1A1
SCHEMBL2208420 0.67 PTPN2 (0.39) KMT2AALDH1A1

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-2023276538-A1 RADIATION-SENSITIVE COMPOSITION, RESIST PATTERN FORMATION METHOD, POLYMER, AND COMPOUND JSR株式会社 2023-01-05 — — WO disclosed
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