SCHEMBL7609552

SCHEMBL7609552

CCCCn1c(=O)c(NC(=O)Nc2c(C(C)C)cc(OCCN3CCCCC3)cc2C(C)C)c(-c2cccc(OC)c2)c2cccnc21

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.70
SOAT1 P35610 1/20 0.68
AVPR1B P47901 3/20 0.45

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
SCHEMBL7612035 0.99 ACAT1 (0.71) ACAT1SOAT1AVPR1B
SCHEMBL7633066 0.97 ACAT1 (0.70) ACAT1SOAT1AVPR1B
SCHEMBL7618247 0.95 ACAT1 (0.70) ACAT1SOAT1AVPR1B
SCHEMBL7616210 0.94 ACAT1 (0.68) ACAT1SOAT1AVPR1B
SCHEMBL6638040 0.93 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL6633600 0.93 ACAT1 (0.74) ACAT1SOAT1AVPR1B
SCHEMBL6636996 0.91 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL7610570 0.90 ACAT1 (0.73) ACAT1SOAT1AVPR1B
SCHEMBL6636733 0.90 ACAT1 (0.62) ACAT1SOAT1AVPR1B
SCHEMBL8328835 0.88 ACAT1 (0.66) ACAT1SOAT1AVPR1B

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
US-6420381-B1 ACYL-COA: CHOLESTEROL ACYL TRANSFERASE (ACAT) INHIBITORY ACTIVITY, AND IS USEFUL AS AN AGENT FOR TREATMENT OF HYPERLIPIDEMIA AND ATHEROSCLEROSIS. SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-07-16 US disclosed
EP-1104763-A1 NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-06-06 EP disclosed