SCHEMBL28909710

SCHEMBL28909710

Cc1cc(Nc2cc(-c3cccc(-n4ccc5cc(C6CC6)ccc5c4=O)c3CO)cn(C)c2=O)ncc1N1CCOCC1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.72
YES1 P07947 1/20 0.58
FGR P09769 1/20 0.58
TEC P42680 1/20 0.58
BMX P51813 1/20 0.58
KCNH2 Q12809 1/20 0.58
SLK Q9H2G2 1/20 0.58

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
SCHEMBL3200245 0.91 BTK (0.88) BTKYES1FGRTECBMX
SCHEMBL1726748 0.87 BTK (0.74) BTKYES1FGRTECBMX
SCHEMBL1726617 0.86 BTK (0.81) BTKYES1FGRTECBMX
SCHEMBL1726871 0.81 BTK (0.81) BTKYES1FGRTECBMX
SCHEMBL1726776 0.81 BTK (0.71) BTKYES1FGRTECBMX
SCHEMBL3207086 0.80 BTK (0.81) BTKYES1FGRTECBMX
SCHEMBL3207565 0.79 BTK (0.71) BTKYES1FGRTECBMX
SCHEMBL14837430 0.79 BTK (0.65) BTKYES1FGRTECBMX
SCHEMBL16417098 0.78 BTK (0.72) BTKYES1FGRTECBMX
SCHEMBL1726013 0.78 BTK (0.68) BTKYES1FGRTECBMX

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-112472699-A Combination methods for improving the therapeutic benefit of bisantrene and derivatives 种族肿瘤学公司 2021-03-12 CN disclosed