SCHEMBL30817868

SCHEMBL30817868

O=S(=O)(F)c1nc2ccccc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 1/20 1.00
▸ PSMB5 P28074 1/20 1.00
▸ CA12 O43570 1/20 0.70
▸ CA1 P00915 1/20 0.70
▸ CA2 P00918 1/20 0.70
▸ CA4 P22748 1/20 0.70
▸ CA7 P43166 1/20 0.70
▸ CA14 Q9ULX7 1/20 0.70
▸ ALDH1A1 P00352 8/20 0.58
▸ MAPT P10636 5/20 0.58
▸ LMNA P02545 4/20 0.58
▸ HTT P42858 4/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ SMN1; SMN2 Q16637 6/20 0.53
▸ AKR1B1 P15121 1/20 0.53
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ HPGD P15428 2/20 0.47

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
SCHEMBL29164335 1.00 PSMB8 (1.00) PSMB8PSMB5CA12CA1CA2
SCHEMBL2711265 0.86 PSMB8 (0.75) PSMB8PSMB5CA12CA1CA2
SCHEMBL329577 0.84 PSMB8 (0.72) PSMB8PSMB5CA12CA1CA2
SCHEMBL329578 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL13851203 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL23626381 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL2754297 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL31463118 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL75415 0.82 PSMB8 (0.70) PSMB8PSMB5CA12CA1CA2
SCHEMBL81178 0.82 CA2 (1.00) PSMB8PSMB5CA12CA1CA2

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
CN-117658750-A Synthesis process of sulfonyl fluoride compound 南京师范大学 2024-03-08 — — CN disclosed
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