SCHEMBL28615944

SCHEMBL28615944

CC(=O)N1CCC(C(=O)N(C)Cc2cc(-c3ccc(Cl)cc3)cc(-c3cc(-c4cc(C(F)(F)F)ccc4Cl)c(C#N)c(=O)[nH]3)c2O)CC1.Cc1ccc(C(C)CCN2CCC(C(=O)N(C)Cc3cc(Cl)cc(-c4cc(-c5cc(C(F)(F)F)ccc5Cl)c(C#N)c(=O)[nH]4)c3O)CC2)o1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 20/20 0.72

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
SCHEMBL2069636 0.93 BIRC5 (0.78) BIRC5
SCHEMBL2072009 0.88 BIRC5 (0.87) BIRC5
SCHEMBL2071469 0.85 BIRC5 (1.00) BIRC5
SCHEMBL2072235 0.83 BIRC5 (1.00) BIRC5
SCHEMBL28527097 0.81 BIRC5 (0.90) BIRC5
SCHEMBL2071970 0.80 BIRC5 (0.84) BIRC5
SCHEMBL2070300 0.80 BIRC5 (0.94) BIRC5
SCHEMBL2072205 0.79 BIRC5 (0.85) BIRC5
SCHEMBL2070645 0.79 BIRC5 (0.91) BIRC5
SCHEMBL2070669 0.79 BIRC5 (0.87) BIRC5

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
CN-113365610-A Methods of making and delivering bisantrene formulations 现代化制药公司 2021-09-07 CN disclosed