SCHEMBL6281705

SCHEMBL6281705

CCCCCCCN(CCN1CCN(CCSc2nc3ccccc3o2)CC1)C(=O)Nc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 9/20 0.68

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
SCHEMBL6280540 0.96 SOAT1 (0.70) SOAT1
SCHEMBL6281760 0.93 SOAT1 (0.61) SOAT1
SCHEMBL6273884 0.90 SOAT1 (0.70) SOAT1
SCHEMBL6305838 0.89 SOAT1 (0.69) SOAT1
SCHEMBL6284663 0.87 SOAT1 (0.51) SOAT1
SCHEMBL8141215 0.85 SOAT1 (0.64) SOAT1
SCHEMBL6283338 0.84 SOAT1 (0.53) SOAT1
SCHEMBL6282148 0.83 SOAT1 (0.62) SOAT1
SCHEMBL6280703 0.82 SOAT1 (0.46) SOAT1
Hydrochloric Acid SCHEMBL6285210 0.82 SOAT1 (0.58) SOAT1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969711-B2 Cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2005-11-29 US disclosed
EP-0987254-B1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME KOWA CO (JP) 2004-12-22 EP disclosed
EP-0987254-A1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-03-22 EP disclosed