SCHEMBL8323652

SCHEMBL8323652

COc1ccc(Cl)c(Oc2c(OCCNC(=O)Nc3cccnc3)ncnc2N(CC(C)C)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 9/20 0.47
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HTT P42858 1/20 0.42
TP53 P04637 1/20 0.41
EDNRB P24530 3/20 0.40
EDNRA P25101 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 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
SCHEMBL8326276 0.94 EDNRB (0.42) HPGDHTTEDNRBEDNRAMEN1
SCHEMBL8326459 0.89 EDNRB (0.41) HPGDEDNRBEDNRAMEN1KMT2A
SCHEMBL8326870 0.87 LMNA (0.40) EDNRBEDNRAMEN1KMT2AMAPT
SCHEMBL8321015 0.83 EDNRA (0.45) HTTEDNRBEDNRAMEN1KMT2A
SCHEMBL8326182 0.81 EDNRB (0.45) HPGDEDNRBEDNRAMEN1KMT2A
SCHEMBL9407273 0.78 MAPT (0.38) HPGDHTTTP53EDNRBEDNRA
SCHEMBL8323649 0.77 EDNRA (0.55) EDNRBEDNRA
SCHEMBL7007654 0.77 MCL1 (0.40) HPGDEDNRBEDNRAMEN1KMT2A
SCHEMBL7009283 0.77 EDNRB (0.40) HPGDHTTEDNRBEDNRAMEN1
SCHEMBL7011111 0.75 EDNRB (0.39) HPGDEDNRBEDNRAMEN1KMT2A

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