SCHEMBL13752170

SCHEMBL13752170

NOOSc1ccc(Nc2nc(Nc3ccc(S(N)(=O)=O)cc3)nc(Nc3ccc(S(N)(=O)=O)cc3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 20/20 0.60
CA2 P00918 20/20 0.60
CA9 Q16790 20/20 0.60
CA12 O43570 12/20 0.58
CA14 Q9ULX7 8/20 0.58
CA4 P22748 3/20 0.58
CA6 P23280 3/20 0.58
CA7 P43166 3/20 0.58
CA13 Q8N1Q1 3/20 0.58
CA5A P35218 2/20 0.58
CA3 P07451 1/20 0.52

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
SCHEMBL14264262 0.82 CA1 (0.86) CA1CA2CA9CA12CA14
SCHEMBL14264259 0.74 CA1 (0.76) CA1CA2CA9CA12CA14
SCHEMBL2004300 0.73 CA1 (0.69) CA1CA2CA9CA12CA14
SCHEMBL13882171 0.72 ALDH1A1 (0.40) CA1CA2CA12CA7CA13
SCHEMBL18475432 0.71 CA9 (1.00) CA1CA2CA9CA12CA14
SCHEMBL28107398 0.69 SOS1 (0.70) CA1CA2CA9CA12CA14
SCHEMBL1652316 0.67 IKBKB (0.64) CA1CA2CA9CA12CA14
SCHEMBL25147636 0.67 CA9 (0.82) CA1CA2CA9CA12CA14
SCHEMBL13896222 0.67 CA1 (0.68) CA1CA2CA9CA12CA14
SCHEMBL30408661 0.67 CA9 (0.82) CA1CA2CA9CA12CA14

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-7576036-B2 Heat-sensitive recording material, heat-sensitive recording method and method for manufacturing heat-sensitive recording material FUJIFILM CORPORATION (JP) 2009-08-18 US disclosed
US-20070032381-A1 Heat-sensitive recording material, heat-sensitive recording method and method for manufacturing heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2007-02-08 US disclosed
US-20070004594-A1 Heat-sensitive recording material and heat-sensitive recording method FUJI PHOTO FILM CO., LTD. 2007-01-04 US disclosed