SCHEMBL6636733

SCHEMBL6636733

COc1cccc(-c2c(NC(=O)Nc3c(C(C)C)cccc3C(C)C)c(=O)n(CCCN3CCCCC3)c3ncccc23)c1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.62
SOAT1 P35610 1/20 0.60
AVPR1B P47901 3/20 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
SCHEMBL7633066 0.91 ACAT1 (0.70) ACAT1SOAT1AVPR1B
SCHEMBL6636996 0.91 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL8324263 0.91 ACAT1 (0.71) ACAT1SOAT1AVPR1B
SCHEMBL7609552 0.90 ACAT1 (0.70) ACAT1SOAT1AVPR1B
SCHEMBL6638805 0.90 ACAT1 (0.75) ACAT1SOAT1
SCHEMBL6640119 0.90 ACAT1 (0.73) ACAT1SOAT1
SCHEMBL6638040 0.89 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL8328190 0.89 ACAT1 (0.63) ACAT1SOAT1AVPR1B
SCHEMBL7612035 0.89 ACAT1 (0.71) ACAT1SOAT1AVPR1B
SCHEMBL6635737 0.89 ACAT1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842933-B1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2004-08-04 EP disclosed
EP-0842933-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-05-20 EP disclosed