SCHEMBL6462708

SCHEMBL6462708

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

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.60
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 2/20 0.52
CYP3A4 P08684 1/20 0.52
THRB P10828 1/20 0.52
NFKB1 P19838 1/20 0.52
HTR2A P28223 1/20 0.52
CYP2C19 P33261 1/20 0.52
ADRA1A P35348 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
MMP1 P03956 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
MMP13 P45452 1/20 0.51
PKM P14618 1/20 0.51

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 0.91 ALDH1A1 (0.57) FBP1ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL6468804 0.88 ALDH1A1 (0.61) FBP1ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL6470242 0.85 FBP1 (0.71) FBP1ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL6470485 0.84 ALDH1A1 (0.51) FBP1ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL21667753 0.83 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2LMNATSHRCYP3A4
SCHEMBL19629814 0.79 MMP2 (0.61) ALDH1A1CA1CA2MMP1MMP2
SCHEMBL6465704 0.79 MMP2 (0.61) ALDH1A1CA1CA2MMP1MMP2
SCHEMBL6464484 0.78 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2CA1CA2MMP1
SCHEMBL8627685 0.78 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2TSHRPKMEGFR
SCHEMBL6467702 0.77 CYP19A1 (0.67) FBP1ALDH1A1SMN1; SMN2EGFRCYP2C9

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 8 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-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
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