SCHEMBL7305832

SCHEMBL7305832

COc1ccccc1Oc1c(Cl)nc(-c2cccnc2)nc1N(CC(C)C)S(=O)(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
DHPS P49366 8/20 0.44
GBA1 P04062 2/20 0.42
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
EDNRA P25101 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL7303989 0.91 DHPS (0.47) DHPSEDNRA
SCHEMBL7302917 0.87 EDNRA (0.51) DHPSEDNRA
SCHEMBL7297143 0.85 DHPS (0.42) DHPSEDNRA
SCHEMBL7305025 0.85 DHPS (0.42) ALDH1A1MAPTMEN1KMT2ADHPS
SCHEMBL7293765 0.84 EDNRA (0.44) ALDH1A1MAPTMEN1KMT2ADHPS
SCHEMBL8322432 0.84 LMNA (0.41) ALDH1A1MEN1GAAKMT2ANPSR1
SCHEMBL7300166 0.82 DHPS (0.38) MEN1KMT2ANPSR1DHPSGBA1
SCHEMBL7302684 0.82 DHPS (0.38) MAPTDHPSEDNRA
SCHEMBL7292782 0.82 EDNRA (0.40) ALDH1A1MEN1GAAKMT2ANPSR1
SCHEMBL7326664 0.81 DHPS (0.42) ALDH1A1MEN1GAAKMT2ANPSR1

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-0526708-B1 Sulfonamide, preparation and use thereof as medicine and intermediate HOFFMANN LA ROCHE (CH) 2000-10-18 EP disclosed
EP-0526708-A1 Sulfonamide, preparation and use thereof as medicine and intermediate F. HOFFMANN-LA ROCHE AG (CH) 1993-02-10 EP disclosed