SCHEMBL31305232

SCHEMBL31305232

COC(=O)c1cc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc(Br)c1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 4/20 0.50
ALPL P05186 9/20 0.49
WDR5 P61964 1/20 0.45
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
HSD17B1 P14061 2/20 0.44
HSD17B2 P37059 2/20 0.44
IDH1 O75874 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL31305098 0.94 FABP4 (0.49) SLC22A12ALPLWDR5FABP4FABP5
SCHEMBL7570846 0.77 SLC22A12 (0.62) SLC22A12ALPLWDR5HSD17B1HSD17B2
SCHEMBL31305132 0.76 SLC22A12 (0.48) SLC22A12ALPLFABP4MEN1KMT2A
SCHEMBL7589183 0.70 SLC40A1 (0.51) SLC22A12ALPLWDR5IDH1
SCHEMBL31305180 0.70 FABP4 (0.52) SLC22A12ALPLFABP4FABP5MEN1
SCHEMBL30549039 0.69 ALPL (0.47) SLC22A12ALPLIDH1
SCHEMBL31159158 0.69 CA12 (0.44) ALPLMEN1KMT2A
SCHEMBL95622 0.68 ALPL (0.58) SLC22A12ALPLFABP4FABP5IDH1
SCHEMBL15360019 0.68 MEN1 (0.49) ALPLWDR5FABP4MEN1KMT2A
SCHEMBL2649114 0.68 KCNK3 (0.57) KMT2A

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-2024238872-A2 ISOINDOLINONE-GLUTARIMIDE ANTIBODY CONJUGATES, AND USES THEREOF FIREFLY BIO, INC. (US) 2024-11-21 WO disclosed