SCHEMBL31055714

SCHEMBL31055714

CC(C)c1cc(F)cc(C(C)C)c1NC(=O)NS(=O)(=O)N1CCN(CC(F)(F)F)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ GSTO1 P78417 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL19272291 0.92 NLRP3 (0.39) GAAMEN1KMT2ATDP1
SCHEMBL31055698 0.91 NLRP3 (0.45) GAAGSTO1
SCHEMBL26975465 0.88 MEN1 (0.48) MEN1KMT2ATDP1
SCHEMBL24922841 0.83 KAT6A (0.39) GSTO1
SCHEMBL22460322 0.83 GAA (0.52) GAAGSTO1MEN1KMT2ATDP1
SCHEMBL22460318 0.82 MEN1 (0.46) MEN1KMT2A
SCHEMBL31055694 0.82 MEN1 (0.39) GAAGSTO1MEN1KMT2A
SCHEMBL31055722 0.81 ACHE (0.41) GAAGSTO1
SCHEMBL31055720 0.81 GAA (0.39) GAAGSTO1
SCHEMBL22433299 0.81 GSTO1 (0.37) GSTO1

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
EP-3416948-B1 INDACENE BEARING SULFONYLUREAS AS ANTI-INFLAMMATORY AGENTS UNIV QUEENSLAND (AU) 2024-07-24 — — EP claimed
Send feedback