SCHEMBL2218910

SCHEMBL2218910

O=S(=O)([O-])c1cc(Nc2nc(Cl)nc(NCCO)n2)ccc1C=Cc1ccc(Nc2nc(Cl)nc(NCCO)n2)cc1S(=O)(=O)O.[H+].[NaH]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 7/20 0.54
CA12 O43570 6/20 0.54
CA1 P00915 6/20 0.54
CA2 P00918 6/20 0.54
CA14 Q9ULX7 4/20 0.54
CA5A P35218 2/20 0.54
CA5B Q9Y2D0 1/20 0.54
ABCG2 Q9UNQ0 1/20 0.49
MAPT P10636 1/20 0.44
CA3 P07451 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42
GBA1 P04062 2/20 0.39
RECQL P46063 1/20 0.39
MCL1 Q07820 1/20 0.39
USP2 O75604 1/20 0.38
APEX1 P27695 1/20 0.38
CHAT P28329 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL2218456 0.93 CA9 (0.59) CA9CA12CA1CA2CA14
SCHEMBL2202963 0.93 CA9 (0.58) CA9CA12CA1CA2CA14
SCHEMBL14391287 0.93 CA9 (0.58) CA9CA12CA1CA2CA14
SCHEMBL2218468 0.92 CA9 (0.60) CA9CA12CA1CA2CA14
SCHEMBL2220496 0.89 CA12 (0.44) CA9CA12CA1CA2CA14
SCHEMBL2219661 0.89 RECQL (0.52) CA9CA12CA1CA2CA14
SCHEMBL14391290 0.88 CA12 (0.56) CA9CA12CA1CA2CA14
SCHEMBL12935328 0.88 CA12 (0.49) CA9CA12CA1CA2CA14
SCHEMBL4617358 0.88 CA12 (0.49) CA9CA12CA1CA2CA14
SCHEMBL2218680 0.87 CA12 (0.44) CA9CA12CA1CA2CA14

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
EP-2722190-A1 Optimized undercoat for thermal recording material Ricoh Industrie France SAS (FR) 2014-04-23 EP disclosed
US-8546300-B2 Thermosensitive recording material and image recording method RICOH COMPANY, LTD. (JP) 2013-10-01 US disclosed
US-20110177941-A1 THERMOSENSITIVE RECORDING MATERIAL AND IMAGE RECORDING METHOD RICOH COMPANY, LTD. (JP) 2011-07-21 US disclosed