SCHEMBL28567652

SCHEMBL28567652

COc1ccccc1Oc1c(N)nc(-c2ccc(Br)cc2)nc1CCO

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHPS P49366 20/20 0.73

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
SCHEMBL28569633 0.90 DHPS (0.72) DHPS
SCHEMBL28914005 0.89 DHPS (0.73) DHPS
SCHEMBL30411675 0.84 DHPS (1.00) DHPS
SCHEMBL28563806 0.84 DHPS (1.00) DHPS
SCHEMBL28588146 0.83 DHPS (0.74) DHPS
SCHEMBL28577961 0.82 DHPS (0.74) DHPS
SCHEMBL28914659 0.82 DHPS (0.74) DHPS
SCHEMBL28568825 0.82 DHPS (0.62) DHPS
SCHEMBL30412509 0.80 DHPS (1.00) DHPS
SCHEMBL28587118 0.80 DHPS (1.00) DHPS

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-112778215-A 2-methoxyphenoxy pyrimidine antitumor compound and preparation method and application thereof 中国医科大学 2021-05-11 CN disclosed