SCHEMBL6326396

SCHEMBL6326396

CCCNC(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccccc2C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.52
CA2 P00918 5/20 0.52
CA9 Q16790 5/20 0.52
CA12 O43570 3/20 0.52
NAMPT P43490 5/20 0.49
ITGAV P06756 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ITGB3 P05106 1/20 0.46
MMP1 P03956 2/20 0.45
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
MMP8 P22894 2/20 0.45
MMP13 P45452 2/20 0.45
FBP1 P09467 1/20 0.45
OPRK1 P41145 1/20 0.45
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
NCOR2 Q9Y618 1/20 0.43

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
SCHEMBL6324183 0.88 ITGAV (0.52) CA1CA2CA9CA12ITGAV
SCHEMBL6323768 0.84 LMNA (0.54) CA1CA2CA9CA12NAMPT
SCHEMBL6322119 0.81 L3MBTL1 (0.59) CA1CA2CA9CA12KMT2A
SCHEMBL6321364 0.81 CA1 (0.61) CA1CA2CA9CA12NAMPT
SCHEMBL6724948 0.81 LMNA (0.54) CA1CA2CA9CA12NAMPT
SCHEMBL6331212 0.80 CA1 (0.61) CA1CA2CA9CA12MMP1
SCHEMBL6329987 0.80 FBP1 (0.61) NAMPTFBP1HPGD
SCHEMBL2303216 0.79 LMNA (0.63) CA1CA2CA9CA12MMP1
SCHEMBL7774865 0.79 CA1 (0.59) CA1CA2CA9CA12NAMPT
SCHEMBL6325395 0.79 HPGD (0.56) CA1CA2CA9CA12KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed