SCHEMBL9926264

SCHEMBL9926264

CN(C)C(=O)c1cnn(C)c1C(=O)CI

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 14/20 0.39
LMNA P02545 1/20 0.35
SPR P35270 1/20 0.34
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 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
SCHEMBL9926248 0.82 KDM4E (0.38) PDE10ALMNACYP1A2CYP2C19ALDH1A1
SCHEMBL1458251 0.80 PDE10A (0.44) PDE10ALMNASPR
SCHEMBL6917068 0.79 MAPT (0.44) PDE10ALMNASPRALDH1A1MAPT
SCHEMBL16260492 0.75 SMN1; SMN2 (0.39) PDE10ALMNASPRALDH1A1
SCHEMBL13772267 0.73 SPR (0.38) PDE10ALMNASPRALDH1A1MAPT
SCHEMBL9926277 0.72 PDE10A (0.49) PDE10AALDH1A1MAPT
SCHEMBL13772265 0.69 HSD11B1 (0.42) PDE10ALMNASPRALDH1A1MAPT
SCHEMBL2373379 0.69 PDE10A (0.49) PDE10ALMNASPR
SCHEMBL15182833 0.69 PDE10A (0.36) PDE10ALMNACYP1A2CYP2C19
SCHEMBL12261124 0.68 LMNA (0.58) LMNACYP1A2CYP2C19

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-2012076430-A1 TRIAZOLOPYRIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-06-14 WO disclosed