SCHEMBL8326276

SCHEMBL8326276

COc1ccc(Cl)c(Oc2c(OCCNC(=O)Nc3ccccc3)ncnc2N(CC(C)C)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 3/20 0.42
EDNRA P25101 3/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HPGD P15428 4/20 0.38
CSF1R P07333 1/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL8323652 0.94 HPGD (0.47) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL8326459 0.92 EDNRB (0.41) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL8326870 0.91 LMNA (0.40) EDNRBEDNRAMEN1KMT2AMAPT
SCHEMBL8321015 0.87 EDNRA (0.45) EDNRBEDNRAMEN1KMT2AMAPT
SCHEMBL8326182 0.85 EDNRB (0.45) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL7007654 0.81 MCL1 (0.40) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL7009283 0.80 EDNRB (0.40) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL9407273 0.80 MAPT (0.38) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL7011111 0.79 EDNRB (0.39) EDNRBEDNRAMEN1KMT2AHPGD
SCHEMBL7009200 0.78 EDNRB (0.38) EDNRBEDNRAMEN1KMT2AHPGD

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