SCHEMBL5814802

SCHEMBL5814802

CCc1ccc(S(=O)(=O)N2CCC(N3COCc4cc(C)ccc43)CC2)cc1.O=c1nc2ccccc2co1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
ALDH1A1 P00352 5/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CD4 P01730 2/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 2/20 0.35
KDM4E B2RXH2 3/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD11B1 P28845 1/20 0.34
GAA P10253 2/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL5781640 0.92 ALDH1A1 (0.35) LMNAALDH1A1L3MBTL1MAPTMEN1
SCHEMBL5782163 0.92 NPSR1 (0.37) LMNAALDH1A1L3MBTL1MAPTHTT
SCHEMBL5782809 0.91 PKM (0.40) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL5781876 0.91 LMNA (0.40) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL5785236 0.90 PKM (0.44) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL5784419 0.87 MAPT (0.41) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL5426422 0.86 ALDH1A1 (0.47) LMNAALDH1A1L3MBTL1CD4MAPT
SCHEMBL5782517 0.86 HTR6 (0.41) LMNAALDH1A1L3MBTL1MAPTPOLB
SCHEMBL5784257 0.85 SMN1; SMN2 (0.42) LMNAALDH1A1L3MBTL1MAPTMEN1
SCHEMBL5781747 0.84 CHRM1 (0.36) LMNAALDH1A1MAPTHTTKMT2A

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-1648886-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2006-04-26 EP claimed
WO-2005014589-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE S.A. (DE) 2005-02-17 WO claimed