SCHEMBL7305025

SCHEMBL7305025

COc1ccccc1Oc1c(Cl)nc(-c2ccoc2)nc1N(CC(C)C)S(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHPS P49366 12/20 0.42
EDNRA P25101 1/20 0.37
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
ALOX15 P16050 2/20 0.36
CYP2C19 P33261 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
RORC P51449 1/20 0.35
MCL1 Q07820 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 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
SCHEMBL7303989 0.88 DHPS (0.47) DHPSEDNRAMCL1
SCHEMBL7328712 0.86 EDNRA (0.48) DHPSEDNRA
SCHEMBL7302684 0.85 DHPS (0.38) DHPSEDNRALMNARORCMAPT
SCHEMBL7297143 0.85 DHPS (0.42) DHPSEDNRARORCMCL1
SCHEMBL7302917 0.85 EDNRA (0.51) DHPSEDNRA
SCHEMBL7305832 0.85 ALDH1A1 (0.44) DHPSEDNRAALDH1A1MEN1MAPT
SCHEMBL8322432 0.84 LMNA (0.41) DHPSEDNRACYP1A2CYP3A4CYP2D6
SCHEMBL7303288 0.84 EDNRA (0.46) DHPSEDNRACYP1A2LMNAMEN1
SCHEMBL7293765 0.83 EDNRA (0.44) DHPSEDNRAALDH1A1LMNAMEN1
SCHEMBL7300166 0.82 DHPS (0.38) DHPSEDNRARORCMEN1KMT2A

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