SCHEMBL8899747

SCHEMBL8899747

CCN(CC)CCNc1nc(NCC2CCC(C(N)=O)CC2)nc2c(OC)cccc12

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
VCP P55072 19/20 0.47
SLC2A1 P11166 1/20 0.39

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
SCHEMBL8900924 0.95 VCP (0.46) VCPSLC2A1
SCHEMBL8911894 0.91 VCP (0.48) VCPSLC2A1
SCHEMBL8899767 0.89 PRKCQ (0.42) VCPSLC2A1
SCHEMBL8898697 0.84 VCP (0.46) VCP
SCHEMBL8900938 0.83 SLC2A1 (0.44) SLC2A1
SCHEMBL8891551 0.82 VCP (0.54) VCP
Hydrochloric Acid SCHEMBL8899106 0.81 VCP (0.53) VCP
SCHEMBL8911900 0.79 KDM1A (0.43) SLC2A1
SCHEMBL8890072 0.79 POLB (0.51) VCPSLC2A1
SCHEMBL8890197 0.75 PDE5A (0.48) VCP

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