SCHEMBL8897909

SCHEMBL8897909

CN(C)CCN(C)c1nc(NCC2CCC(C(N)=O)CC2)nc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 4/20 0.55
ADRA2A P08913 3/20 0.55
MCHR1 Q99705 3/20 0.50
VCP P55072 15/20 0.47

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
SCHEMBL3947713 0.89 ADRA2A (0.69) NPY5RADRA2AMCHR1VCP
SCHEMBL8907330 0.87 NPY5R (0.57) NPY5RADRA2AMCHR1
SCHEMBL8897920 0.87 NPY5R (0.57) NPY5RADRA2AMCHR1
SCHEMBL8890197 0.84 PDE5A (0.48) NPY5RADRA2AVCP
SCHEMBL8899135 0.83 TRIM58 (0.53) NPY5RADRA2AMCHR1VCP
SCHEMBL2636279 0.80 NPY5R (0.61) NPY5RADRA2AMCHR1VCP
SCHEMBL8889919 0.79 VCP (0.52) VCP
Hydrochloric Acid SCHEMBL2675355 0.79 NPY5R (0.60) NPY5RADRA2AMCHR1VCP
SCHEMBL8906952 0.78 NPY5R (0.46) NPY5RADRA2AMCHR1VCP
SCHEMBL8898697 0.77 VCP (0.46) NPY5RADRA2AVCP

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
WO-1997020823-A2 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 1997-06-12 WO claimed
WO-1997020823-A2 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 1997-06-12 WO disclosed