SCHEMBL8327412

SCHEMBL8327412

CC(C)CCn1c(=O)c(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(-c2cccc(OCCN3CCOCC3)c2)c2cccnc21

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.61
SOAT1 P35610 1/20 0.59
AVPR1B P47901 1/20 0.42
EPHX2 P34913 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41

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
SCHEMBL8326881 0.93 ACAT1 (0.62) ACAT1SOAT1AVPR1B
SCHEMBL6641007 0.93 ACAT1 (0.71) ACAT1SOAT1AVPR1BEPHX2
SCHEMBL8328766 0.91 ACAT1 (0.61) ACAT1SOAT1AVPR1BEPHX2
SCHEMBL8324862 0.90 ACAT1 (0.64) ACAT1SOAT1AVPR1BEPHX2
SCHEMBL8328190 0.90 ACAT1 (0.63) ACAT1SOAT1AVPR1B
SCHEMBL6635269 0.86 ACAT1 (0.63) ACAT1SOAT1
SCHEMBL7616210 0.86 ACAT1 (0.68) ACAT1SOAT1AVPR1B
SCHEMBL6633600 0.86 ACAT1 (0.74) ACAT1SOAT1AVPR1B
SCHEMBL6638040 0.85 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL8331189 0.85 ACAT1 (0.65) 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