SCHEMBL3650690

SCHEMBL3650690

Cc1cc(C)n(-c2nc(Nc3ccc(Cl)cc3)cnc2NC(=O)O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.52
MAPT P10636 5/20 0.52
TP53 P04637 2/20 0.46
KCNN2 Q9H2S1 1/20 0.44
KCNN3 Q9UGI6 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 2/20 0.42
THRB P10828 1/20 0.42
LMNA P02545 1/20 0.41
ALPG P10696 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PIK3CA P42336 1/20 0.41

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
SCHEMBL2885397 0.87 BCL6 (0.46) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL13067901 0.87 BCL6 (0.46) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2890629 0.83 BCL6 (0.53) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2890844 0.81 BCL6 (0.54) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2889491 0.80 BCL6 (0.47) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2891251 0.80 BCL6 (0.51) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2890777 0.80 BCL6 (0.51) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2885622 0.78 BCL6 (0.51) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL3651956 0.78 BCL6 (0.44) BCL6MAPTTP53KCNN2KCNN3
SCHEMBL2889465 0.77 BCL6 (0.48) BCL6MAPTTP53KCNN2KCNN3

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
EP-2203436-A1 PYRAZINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-07-07 EP disclosed
WO-2009037247-A1 PYRAZINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-03-26 WO disclosed