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SCHEMBL8330788

SCHEMBL8330788

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

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACAT1 P24752 1/20 0.65
▸ SOAT1 P35610 1/20 0.63
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 1/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL6636574 0.93 ACAT1 (0.75) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL8326341 0.92 ACAT1 (0.74) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL8328649 0.91 ACAT1 (0.67) ACAT1SOAT1ADORA2AADORA1
SCHEMBL8327437 0.91 ACAT1 (0.68) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL6635246 0.90 SOAT1 (0.66) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL8328836 0.90 ACAT1 (0.66) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL8331189 0.90 ACAT1 (0.65) ACAT1SOAT1
SCHEMBL6635566 0.90 ACAT1 (0.75) ACAT1SOAT1PDE4A
SCHEMBL8328479 0.89 ACAT1 (0.69) ACAT1SOAT1ADORA2AADORA1PDE4A
SCHEMBL8327606 0.89 ACAT1 (0.54) 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