SCHEMBL8327432

SCHEMBL8327432

CCN(CC)CCOc1cccc(-c2c(NC(=O)Nc3c(C(C)C)cccc3C(C)C)c(=O)n(CC3CCCCC3)c3ncccc23)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.58
SOAT1 P35610 1/20 0.56
AVPR1B P47901 1/20 0.38
PDE4A P27815 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL6636746 0.97 ACAT1 (0.60) ACAT1SOAT1AVPR1BPDE4AKCNH2
SCHEMBL8329443 0.89 ACAT1 (0.56) ACAT1SOAT1
SCHEMBL8327437 0.88 ACAT1 (0.68) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8325381 0.88 ACAT1 (0.62) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8325642 0.87 ACAT1 (0.61) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8331189 0.87 ACAT1 (0.65) ACAT1SOAT1
SCHEMBL6636574 0.87 ACAT1 (0.75) ACAT1SOAT1PDE4A
SCHEMBL8324464 0.86 ACAT1 (0.56) ACAT1SOAT1
SCHEMBL8327148 0.86 ACAT1 (0.54) ACAT1SOAT1PDE4AKCNH2
SCHEMBL6634606 0.86 ACAT1 (0.60) ACAT1SOAT1

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-0947515-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-10-06 EP disclosed