SCHEMBL6468804

SCHEMBL6468804

COc1ccc(S(=O)(=O)NC(=O)NCCCNC(=O)NS(=O)(=O)c2ccc(OC)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
CYP2C9 P11712 2/20 0.61
LMNA P02545 2/20 0.61
TSHR P16473 2/20 0.61
ALB P02768 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
PKM P14618 1/20 0.58
FBP1 P09467 5/20 0.56
CYP3A4 P08684 1/20 0.55
THRB P10828 1/20 0.55
NFKB1 P19838 1/20 0.55
HTR2A P28223 1/20 0.55
CYP2C19 P33261 1/20 0.55
ADRA1A P35348 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
MMP1 P03956 1/20 0.54

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
SCHEMBL6467327 0.94 ALDH1A1 (0.57) ALDH1A1CYP2C9LMNATSHRALB
SCHEMBL6462708 0.88 FBP1 (0.60) ALDH1A1CYP2C9LMNATSHRALB
SCHEMBL6470485 0.87 ALDH1A1 (0.51) ALDH1A1CYP2C9LMNATSHRALB
SCHEMBL21667753 0.86 ALDH1A1 (0.57) ALDH1A1CYP2C9LMNATSHRALB
SCHEMBL6465704 0.81 MMP2 (0.61) ALDH1A1PKMHSD17B10CA1CA2
SCHEMBL19629814 0.81 MMP2 (0.61) ALDH1A1PKMHSD17B10CA1CA2
SCHEMBL8627685 0.80 ALDH1A1 (0.66) ALDH1A1CYP2C9TSHRPKMSMN1; SMN2
SCHEMBL6464484 0.80 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2CA1CA2MMP1
SCHEMBL6467702 0.79 CYP19A1 (0.67) ALDH1A1CYP2C9FBP1SMN1; SMN2EGFR
SCHEMBL2005277 0.79 FBP1 (0.70) FBP1

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-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
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
EP-0792755-B1 Thermosensitive recording material OJI PAPER CO (JP) 1998-11-11 EP disclosed
EP-0792755-A1 Thermosensitive recording material OJI PAPER COMPANY LIMITED (JP) 1997-09-03 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