SCHEMBL6322845

SCHEMBL6322845

Cc1ccc(S(=O)(=O)CCOCCOCCOC(=O)c2ccc(NC(=O)NS(=O)(=O)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
TP53 P04637 2/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA4 P22748 2/20 0.53
CA6 P23280 2/20 0.53
CA5A P35218 2/20 0.53
CA7 P43166 2/20 0.53
CA13 Q8N1Q1 2/20 0.53
CA14 Q9ULX7 2/20 0.53
LMNA P02545 3/20 0.52
PPARG P37231 1/20 0.51
RAB9A P51151 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
NR2E3 Q9Y5X4 1/20 0.51
NCOR2 Q9Y618 1/20 0.51
KMT2A Q03164 5/20 0.48
GAA P10253 1/20 0.48
HRH3 Q9Y5N1 2/20 0.48

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
SCHEMBL6322059 1.00 CA2 (0.53) CA2CA9TP53CA12CA1
SCHEMBL6324838 0.94 CA2 (0.51) CA2CA9TP53CA12CA1
SCHEMBL6332397 0.94 CA2 (0.57) CA2CA9TP53CA12CA1
SCHEMBL6323558 0.89 CA2 (0.55) CA2CA9TP53CA12CA1
SCHEMBL6321178 0.88 CA2 (0.54) CA2CA9TP53CA12CA1
SCHEMBL6731502 0.88 CA2 (0.54) CA2CA9TP53CA12CA1
SCHEMBL6324679 0.88 LMNA (0.51) CA2CA9TP53CA12CA1
SCHEMBL6329326 0.88 LMNA (0.51) CA2CA9TP53CA12CA1
SCHEMBL6324525 0.88 CA2 (0.53) CA2CA9TP53CA12CA1
SCHEMBL6723821 0.86 CA2 (0.61) CA2CA9TP53CA12CA1

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