SCHEMBL25929504

SCHEMBL25929504

N#Cc1ccc(N2CCC(c3ccc(OCCCCC4CCNCC4)cc3)CC2)cc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.41
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL30493393 1.00 AR (0.41) ARITGB3ITGA2BHRH2HRH1
SCHEMBL30493385 0.87 AR (0.41) AR
SCHEMBL25329631 0.87 AR (0.43) ARHRH2HRH1HRH3
SCHEMBL25931248 0.87 AR (0.41) AR
SCHEMBL25329565 0.86 AR (0.42) AR
SCHEMBL31131387 0.86 AR (0.42) AR
SCHEMBL25931177 0.86 AR (0.42) AR
SCHEMBL25330085 0.85 AR (0.41) AR
SCHEMBL25330466 0.85 AR (0.41) AR
SCHEMBL25328831 0.85 AR (0.44) AR

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
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 WO disclosed