SCHEMBL28589605

SCHEMBL28589605

COc1ccccc1Oc1c(Cl)nc(-c2ccc(Cl)cc2)nc1Cl

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHPS P49366 20/20 0.82

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
SCHEMBL7303389 0.91 DHPS (0.81) DHPS
SCHEMBL28583679 0.90 DHPS (1.00) DHPS
SCHEMBL30412009 0.90 DHPS (1.00) DHPS
SCHEMBL7293762 0.90 DHPS (0.82) DHPS
SCHEMBL28584053 0.90 DHPS (0.82) DHPS
SCHEMBL28581580 0.90 DHPS (0.82) DHPS
SCHEMBL28916573 0.88 DHPS (0.83) DHPS
SCHEMBL4071996 0.87 DHPS (0.67) DHPS
SCHEMBL6971895 0.85 DHPS (0.62) DHPS
SCHEMBL28577446 0.84 DHPS (0.83) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112898208-B Phenylpyrimidine amine antitumor compound and preparation method and application thereof 中国医科大学 2023-06-20 CN disclosed
CN-112898208-A Phenyl pyrimidinamine antitumor compound and preparation method and application thereof 中国医科大学 2021-06-04 CN disclosed