SCHEMBL497266

SCHEMBL497266

C[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(NCC(N)=O)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MOGAT2 Q3SYC2 1/20 0.39
CNR2 P34972 1/20 0.38
LTA4H P09960 2/20 0.38
CYP2D6 P10635 3/20 0.37
OPRK1 P41145 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
BRD4 O60885 2/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
DRD3 P35462 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL497268 0.84 ALDH1A1 (0.41) MOGAT2CNR2LTA4HLMNASMN1; SMN2
SCHEMBL3805223 0.83 ALDH1A1 (0.45) LTA4HLMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL81946 0.83 ALDH1A1 (0.45) LTA4HLMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL82653 0.82 ALDH1A1 (0.40) CYP2D6OPRK1LMNASMN1; SMN2ALDH1A1
SCHEMBL5538246 0.82 GRIN1 (0.48) MOGAT2CNR2LTA4HLMNASMN1; SMN2
SCHEMBL82791 0.82 GRIN1 (0.48) MOGAT2CNR2LTA4HLMNASMN1; SMN2
SCHEMBL5506542 0.82 GRIN1 (0.48) MOGAT2CNR2LTA4HLMNASMN1; SMN2
SCHEMBL82792 0.82 GRIN1 (0.48) MOGAT2CNR2LTA4HLMNASMN1; SMN2
SCHEMBL83032 0.80 ALDH1A1 (0.42) LTA4HLMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL83427 0.80 ALDH1A1 (0.43) MOGAT2LTA4HCYP2D6LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106045-B2 2-morpholino-4-pyrimidone compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-31 US disclosed
EP-1805164-B9 6-(PYRIDINYL)-4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2011-09-07 EP disclosed
EP-1805164-B1 6-(PYRIDINYL)-4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2011-02-23 EP disclosed
EP-2266979-A1 2-morpholino-4-pyrimidone compounds Mitsubishi Tanabe Pharma Corporation (JP) 2010-12-29 EP disclosed