SCHEMBL6464097

SCHEMBL6464097

COCCS(=O)(=O)N(C(N)=O)c1ccc(Cc2ccc(N(C(N)=O)S(=O)(=O)CCOC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.40
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ALDH1A1 P00352 4/20 0.36
GAA P10253 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
STS P08842 1/20 0.33
LTA4H P09960 3/20 0.33

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 0.86 LMNA (0.43) ALDH1A1GAASMN1; SMN2CYP3A4LTA4H
SCHEMBL6462900 0.83 GRM2 (0.40) TDP1HDAC1HDAC6ALDH1A1GAA
SCHEMBL6468752 0.82 LTA4H (0.44) ALDH1A1LTA4H
SCHEMBL9435801 0.82 CNR2 (0.45) TDP1HDAC1HDAC6ALDH1A1HPGD
SCHEMBL6467539 0.81 CA1 (0.32) HDAC1HDAC6CA2CA1CA9
SCHEMBL8626825 0.79 ALDH1A1 (0.42) TDP1HDAC1HDAC6ALDH1A1GAA
SCHEMBL6466488 0.79 SAE1 (0.44) ALDH1A1GAAHPGDCA2CA12
SCHEMBL6466087 0.77 KMT2A (0.41) ALDH1A1KDM4EKMT2AMAPT
SCHEMBL6463099 0.75 HSP90AA1 (0.49) ALDH1A1HPGDKDM4ECA2CA12
SCHEMBL6464370 0.75 PLA2G10 (0.33) TDP1HDAC1HDAC6ALDH1A1CA2

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