SCHEMBL8327752

SCHEMBL8327752

COc1ccc(Oc2c(Cl)ncnc2N(CC(C)C)S(=O)(=O)c2ccccc2)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
MCL1 Q07820 5/20 0.38
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
BCL2L1 Q07817 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7306778 0.87 LMNA (0.39) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL8326451 0.85 EDNRA (0.41) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7295453 0.83 LMNA (0.37) RORCALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL7009283 0.80 EDNRB (0.40) RORCGAAMEN1KMT2APOLB
SCHEMBL7011111 0.79 EDNRB (0.39) RORCMEN1KMT2APOLBMAPT
SCHEMBL7007654 0.79 MCL1 (0.40) RORCGAAMEN1KMT2APOLB
SCHEMBL7009200 0.78 EDNRB (0.38) RORCALDH1A1GAAMEN1KMT2A
SCHEMBL8326182 0.76 EDNRB (0.45) RORCGAAMEN1KMT2APOLB
SCHEMBL8321015 0.76 EDNRA (0.45) GAAMEN1KMT2APOLBMAPT
SCHEMBL8322432 0.76 LMNA (0.41) RORCALDH1A1CYP1A2CYP3A4CYP2D6

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-0633259-B1 Sulfonylaminopyrimidines, their preparation and their use as medicine HOFFMANN LA ROCHE (CH) 1999-01-13 EP disclosed
EP-0633259-A1 Sulfonylaminopyrimidines, their preparation and their use as medicine F. HOFFMANN-LA ROCHE AG (CH) 1995-01-11 EP disclosed