SCHEMBL6466488

SCHEMBL6466488

COc1ccc(CS(=O)(=O)N(C(N)=O)c2ccc(Cc3ccc(N(C(N)=O)S(=O)(=O)Cc4ccc(OC)cc4)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 1/20 0.44
UBA2 Q9UBT2 1/20 0.44
MCL1 Q07820 1/20 0.43
LTA4H P09960 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
APLNR P35414 1/20 0.40
F2 P00734 1/20 0.39
HPGD P15428 1/20 0.39
CYP1A2 P05177 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
SCHEMBL27586728 0.89 ALDH1A1 (0.50) KMT2AALDH1A1LMNAKEAP1NFE2L2
SCHEMBL6466688 0.85 LMNA (0.43) SAE1UBA2MCL1LTA4HALDH1A1
SCHEMBL6466087 0.85 KMT2A (0.41) KMT2AALDH1A1LMNATP53KEAP1
SCHEMBL8620628 0.84 TP53 (0.55) KMT2AALDH1A1LMNATP53KEAP1
SCHEMBL6463099 0.83 HSP90AA1 (0.49) LTA4HCA12CA1CA2CA9
SCHEMBL6469558 0.82 KDM4E (0.40) KMT2AMEN1HTTCA12CA1
SCHEMBL6462900 0.79 GRM2 (0.40) KMT2AHTTCA12CA1CA2
SCHEMBL6464097 0.79 TDP1 (0.40) SAE1UBA2LTA4HKMT2AHTT
SCHEMBL8626825 0.76 ALDH1A1 (0.42) KMT2AHTTCA12CA1CA2
SCHEMBL8662172 0.75 TP53 (0.51) KMT2AALDH1A1LMNATP53KEAP1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050255998-A1 Mixture of colour developers CIBA SPECIALTY CHEMICALS CORP. 2005-11-17 US disclosed
EP-1480835-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
EP-1480836-A1 MIXTURE OF COLOUR DEVELOPERS Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
US-5612280-A AROMATIC SULFONYLUREA AND SULFONYLTHIOUREA DERIVATIVES AS COLOR DEVELOPERS; COLORFASTNESS, STORAGE STABILITY, WHITENESS NEW OJI PAPER CO., LTD. (JP) 1997-03-18 US disclosed