SCHEMBL12825965

SCHEMBL12825965

CCNC(=O)c1cnn(C)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 10/20 0.76
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 5/20 0.48
MAPK1 P28482 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 5/20 0.45
RAB9A P51151 5/20 0.45
LMNA P02545 2/20 0.45
GFER P55789 2/20 0.45
POLB P06746 2/20 0.45
NPC1 O15118 2/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL1457802 0.91 PDE10A (0.73) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL6889025 0.91 PDE10A (0.81) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1458265 0.90 PDE10A (0.72) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL6889411 0.90 PDE10A (0.80) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1458526 0.90 PDE10A (0.82) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1458378 0.90 PDE10A (0.71) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1458407 0.90 PDE10A (0.71) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1457776 0.90 PDE10A (0.71) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL1458278 0.90 PDE10A (0.71) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD
SCHEMBL6888553 0.89 PDE10A (0.78) PDE10ASMN1; SMN2ALDH1A1MAPK1HPGD

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-2011036127-A1 IMIDAZOPYRIDINE OR IMIDAZOPYRIMIDINE DERIVATIVES AS PHOSPHODIESTERASE 10A INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-03-31 WO disclosed