SCHEMBL8565623

SCHEMBL8565623

CCCCn1c(=O)c(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(-c2ccccn2)c2cccnc21

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.61
SOAT1 P35610 1/20 0.60
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
HTR3A P46098 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42

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
SCHEMBL6634662 0.89 ACAT1 (0.59) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL8569606 0.89 ACAT1 (0.65) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6634873 0.88 ACAT1 (0.62) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6636597 0.88 ACAT1 (0.64) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6633460 0.87 ACAT1 (0.70) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL8327807 0.87 ACAT1 (0.63) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6639148 0.87 ACAT1 (0.65) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6634525 0.87 ACAT1 (0.70) ACAT1SOAT1PDE4APDE4BPDE4C
SCHEMBL6634839 0.87 ACAT1 (0.59) ACAT1SOAT1
SCHEMBL8328652 0.86 ACAT1 (0.69) ACAT1SOAT1PDE4APDE4BPDE4C

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
EP-0842933-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-05-20 EP disclosed