SCHEMBL6464484

SCHEMBL6464484

COc1ccc(S(=O)(=O)NC(=O)NCc2ccc(CNC(=O)NS(=O)(=O)c3ccc(OC)cc3)o2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
EGFR P00533 5/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
NAMPT P43490 3/20 0.48
ERBB2 P04626 4/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.46
CTDSP1 Q9GZU7 1/20 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
SCHEMBL6242875 0.85 ALDH1A1 (0.63) SMN1; SMN2CA1CA2KMT2AALDH1A1
SCHEMBL6467327 0.83 ALDH1A1 (0.57) SMN1; SMN2EGFRCA1CA2MMP1
SCHEMBL8627685 0.81 ALDH1A1 (0.66) SMN1; SMN2EGFRNAMPTERBB2ALDH1A1
SCHEMBL6468804 0.80 ALDH1A1 (0.61) SMN1; SMN2EGFRCA1CA2MMP1
SCHEMBL6467702 0.80 CYP19A1 (0.67) SMN1; SMN2EGFRNAMPTERBB2ALDH1A1
SCHEMBL6462708 0.78 FBP1 (0.60) SMN1; SMN2EGFRCA1CA2MMP1
SCHEMBL6470485 0.77 ALDH1A1 (0.51) SMN1; SMN2EGFRCA1CA2MMP1
SCHEMBL19629814 0.76 MMP2 (0.61) EGFRCA1CA2MMP1MMP2
SCHEMBL6465704 0.76 MMP2 (0.61) EGFRCA1CA2MMP1MMP2
SCHEMBL21667753 0.76 ALDH1A1 (0.57) SMN1; SMN2EGFRCA1CA2MMP1

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-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