SCHEMBL6468752

SCHEMBL6468752

NC(=O)N(c1ccc(Cc2ccc(N(C(N)=O)S(=O)(=O)CCOc3ccccc3)cc2)cc1)S(=O)(=O)CCOc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 16/20 0.44
PARP10 Q53GL7 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL6466688 0.88 LMNA (0.43) LTA4HALDH1A1
SCHEMBL6464097 0.82 TDP1 (0.40) LTA4HALDH1A1
SCHEMBL6463099 0.78 HSP90AA1 (0.49) LTA4HALDH1A1
SCHEMBL6462883 0.74 PTGES (0.52)
SCHEMBL6462900 0.74 GRM2 (0.40) ALDH1A1
SCHEMBL9435801 0.74 CNR2 (0.45) ALDH1A1
SCHEMBL6465397 0.74 CA1 (0.52) PARP10ALDH1A1
SCHEMBL6244071 0.74 KMT2A (0.57) ALDH1A1
SCHEMBL6467690 0.72 KMT2A (0.51) ALDH1A1
SCHEMBL6466488 0.71 SAE1 (0.44) LTA4HALDH1A1

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 7 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
US-20050106491-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-05-19 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-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS 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