SCHEMBL29664854

SCHEMBL29664854

CC1(C)[C@@H]2C[C@H]3OB(c4ccccc4S(N)(=O)=O)O[C@@]3(C)[C@H]1C2

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 1/20 0.43
▸ PREP P48147 7/20 0.42
▸ F2 P00734 7/20 0.42
▸ PRSS1 P07477 4/20 0.42
▸ PSMB5 P28074 4/20 0.37
▸ PSEN1 P49768 1/20 0.36
▸ PSEN2 P49810 1/20 0.36
▸ APH1B Q8WW43 1/20 0.36
▸ NCSTN Q92542 1/20 0.36
▸ APH1A Q96BI3 1/20 0.36
▸ PSENEN Q9NZ42 1/20 0.36

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
SCHEMBL15891771 0.80 CXCR2 (0.53) CXCR2PREPF2PRSS1PSMB5
SCHEMBL29664611 0.79 F2 (0.42) CXCR2PREPF2PRSS1PSMB5
SCHEMBL5899540 0.77 CXCR2 (0.42) CXCR2PREPF2PRSS1PSMB5
SCHEMBL5899514 0.77 CXCR2 (0.42) CXCR2PREPF2PRSS1PSMB5
SCHEMBL12721154 0.76 PREP (0.48) CXCR2PREPF2PRSS1PSMB5
SCHEMBL15890142 0.76 CXCR2 (0.49) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL13197066 0.73 CXCR2 (0.51) CXCR2PREPF2PRSS1PSMB5
SCHEMBL21012782 0.73 CXCR2 (0.40) CXCR2PREPF2PRSS1PSMB5
SCHEMBL16075596 0.72 CXCR2 (0.42) CXCR2PREPF2PSMB5
SCHEMBL22080961 0.71 PREP (0.40) CXCR2PREPF2PSMB5PSEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4251630-A1 SULFONYL UREA NLRP3 INFLAMMASOME INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2023-10-04 — — EP disclosed
WO-2022115417-A1 SULFONYL UREA NLRP3 INFLAMMASOME INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2022-06-02 — — WO disclosed
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