SCHEMBL31404237

SCHEMBL31404237

OCCN=Cc1ccccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.81
CA2 P00918 7/20 0.81
KDM4E B2RXH2 2/20 0.81
CA9 Q16790 6/20 0.75
CA1 P00915 1/20 0.53
SIRT2 Q8IXJ6 1/20 0.52
ALDH1A1 P00352 4/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
POLB P06746 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CTRC Q99895 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 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
SCHEMBL4603113 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
SCHEMBL12545899 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
SCHEMBL4603115 1.00 CA12 (0.81) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL18852430 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL711494 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL11613427 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL4290399 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL29356999 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL22229 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1
N,N'-Disalicylalethylenediamine SCHEMBL247862 0.90 CA12 (1.00) CA12CA2KDM4ECA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025073644-A1 NON-TOXIC LATENT POLYMERIZATION CATALYSTS FOR POLYURETHANES BASED ON TIN (IV) CHELATE COMPLEXES TECH SYNT LTD (GB) 2025-04-10 WO disclosed
EP-4534577-A1 NON-TOXIC LATENT POLYMERIZATION CATALYSTS FOR POLYURETHANES BASED ON TIN (IV) CHELATE COMPLEXES Tech Synt Ltd (GB) 2025-04-09 EP disclosed