SCHEMBL6467730

SCHEMBL6467730

O=C(Nc1cccc(NC(=O)NS(=O)(=O)Cc2ccccc2)c1)NS(=O)(=O)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.51
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
NPC1 O15118 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
MET P08581 2/20 0.47
SIRT1 Q96EB6 1/20 0.47
MGLL Q99685 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGAV P06756 1/20 0.47
KMT2A Q03164 2/20 0.46

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
SCHEMBL6464498 0.92 ACP1 (0.61) ACP1CA1CA2MMP1MMP2
SCHEMBL29402397 0.87 IDH1 (0.55) CA1CA2MAPTALDH1A1CA12
SCHEMBL6463105 0.83 CA1 (0.57) ACP1CA1CA2MMP1MMP2
SCHEMBL8726377 0.82 CA1 (0.55) ACP1CA1CA2MMP1MMP2
SCHEMBL8091378 0.82 CNR1 (0.57) ACP1CA1CA2MMP1MMP2
SCHEMBL6468349 0.81 PGR (0.62) CA1CA2CA12CA9MET
SCHEMBL29400026 0.80 NAMPT (0.58) GAAALDH1A1KMT2AMEN1NAMPT
SCHEMBL6467531 0.80 KDM4E (0.52) CA1CA2MAPTGAAMMP1
SCHEMBL1345097 0.79 LMNA (0.49) MAPTGAAALDH1A1METKMT2A
SCHEMBL6466509 0.79 MET (0.61) CA1CA2MAPTNPC1ALDH1A1

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 9 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-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
EP-0604832-B1 Thermosensitive recording material OJI PAPER CO (JP) 1998-06-03 EP 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
EP-0604832-A2 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-07-06 EP disclosed