SCHEMBL1290194

SCHEMBL1290194

Clc1cn2nccc2nc1Cl

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.42
DYRK1A Q13627 1/20 0.36
KCNN3 Q9UGI6 2/20 0.33
SCN5A Q14524 1/20 0.32
KCNN1 Q92952 1/20 0.32
KCNN2 Q9H2S1 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
P2RX7 Q99572 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL15690188 0.82 PDE10A (0.35) PDE10ADYRK1ASCN5A
SCHEMBL15690266 0.82 PDE10A (0.35) PDE10ADYRK1AKCNN3
SCHEMBL30852894 0.77 KCNN3 (0.39) PDE10AKCNN3KDM4E
SCHEMBL2968326 0.77 AKT1 (0.39) DYRK1AKDM4E
SCHEMBL22978874 0.76 PDE10A (0.32) PDE10ADYRK1AKCNN3KCNN1KCNN2
SCHEMBL22996432 0.74 SIRT2 (0.31) PDE10A
SCHEMBL2978671 0.71 KDR (0.40)
SCHEMBL22996562 0.71 KMT2A (0.35)
SCHEMBL31514478 0.70 MAPK14 (0.41) KCNN3KCNN1KCNN2TDP1P2RX7
SCHEMBL405358 0.70 DYRK1A (0.47) PDE10ADYRK1AKCNN3SCN5AKCNN1

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
WO-2012047569-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-04-12 WO disclosed