SCHEMBL17599308

SCHEMBL17599308

CCCCCCC=Cc1cc(-c2cccc(C(=O)OC(C)(C)C)c2)c2ccccc2c1NS(=O)(=O)c1c(C)c(C)cc(C)c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CRHBP P24387 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CRHR2 Q13324 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PDCD1 Q15116 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33
▸ FNTA P49354 1/20 0.32
▸ FNTB P49356 1/20 0.32
▸ RCE1 Q9Y256 1/20 0.32
▸ LIPG Q9Y5X9 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ABCB1 P08183 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ PTPN11 Q06124 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
SCHEMBL17599321 0.85 MCL1 (0.35) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599354 0.82 FAAH (0.33) FAAHPDCD1CD274PTPN11PPARA
SCHEMBL17599409 0.80 MEN1 (0.38) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599386 0.76 MEN1 (0.37) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599380 0.76 MEN1 (0.44) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599393 0.73 MCL1 (0.42) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599366 0.70 KDM4E (0.41) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17599346 0.68 CDC25B (0.45) KDM4EMEN1ALDH1A1HPGDCRHBP
SCHEMBL17613335 0.62 ABCG2 (0.37) MAPTABCB1ABCG2SLC7A5SMN1; SMN2
SCHEMBL17599410 0.61 ABCG2 (0.35) ABCB1ABCG2SLC7A5

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-2998294-A1 Naphthyl sulfonamide phenyl derivatives as KEAP-1 modulators for the treatment of diabetes, obesity, dyslipidemia and related disorders SANOFI (FR) 2016-03-23 — — EP disclosed
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