SCHEMBL12856460

SCHEMBL12856460

COc1ccc2c(c1Cl)/C(=N/Nc1ccc(S(N)(=O)=O)cc1)C(=O)N2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.46
CA1 P00915 13/20 0.43
CA2 P00918 13/20 0.43
CA9 Q16790 9/20 0.43
CA12 O43570 8/20 0.43
KDR P35968 1/20 0.42
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CA4 P22748 3/20 0.40
CA7 P43166 3/20 0.40
CDK2 P24941 2/20 0.39
CDK1 P06493 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL12856489 0.86 EIF2AK2 (0.49) EIF2AK2CA1CA2CA9CA12
SCHEMBL14040777 0.81 EIF2AK2 (0.45) EIF2AK2CA1CA2CA9CA12
SCHEMBL5167566 0.80 CA1 (0.47) EIF2AK2CA1CA2CA9CA12
SCHEMBL5427801 0.80 CA1 (0.47) EIF2AK2CA1CA2CA9CA12
SCHEMBL5421135 0.78 EIF2AK2 (0.46) EIF2AK2CA1CA2CA9CA12
SCHEMBL5421128 0.78 EIF2AK2 (0.46) EIF2AK2CA1CA2CA9CA12
SCHEMBL5740387 0.78 CES1 (0.38) CA1CA2CA9KDM4ELMNA
SCHEMBL14040841 0.77 EIF2AK2 (0.46) EIF2AK2CA1CA2CA9CA12
SCHEMBL5439438 0.76 CA1 (0.67) EIF2AK2CA1CA2CA9CA12
SCHEMBL5171527 0.76 CA1 (0.67) EIF2AK2CA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1364212-B1 THREE HYBRID ASSAY SYSTEM GPC BIOTECH AG (DE) 2011-02-02 EP disclosed