SCHEMBL29487346

SCHEMBL29487346

Oc1nc(O)c2cc(F)c(Br)cc2n1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33

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
SCHEMBL22234298 1.00 EGLN1 (0.33) EGLN1ESR1ESR2
SCHEMBL31537826 0.93 ESR1 (0.33) EGLN1ESR1ESR2
SCHEMBL30099275 0.78 BCHE (0.31)
SCHEMBL24579692 0.78 AHR (0.32) ESR1ESR2
SCHEMBL27053757 0.78 ESR1 (0.32) ESR1ESR2
SCHEMBL30952065 0.74
SCHEMBL21456827 0.74 EGFR (0.37)
SCHEMBL16637079 0.74 CSNK2A1 (0.37) ESR1ESR2
SCHEMBL30615125 0.74 PDE4A (0.37)
SCHEMBL29091608 0.74 PDE4A (0.37)

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-114206841-A CD73 inhibitor 博奥阿迪斯生物科技公司 2022-03-18 CN disclosed