SCHEMBL30412009

SCHEMBL30412009

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHPS P49366 20/20 1.00

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
SCHEMBL28583679 1.00 DHPS (1.00) DHPS
SCHEMBL30410967 0.92 DHPS (1.00) DHPS
SCHEMBL28573132 0.92 DHPS (1.00) DHPS
SCHEMBL29015747 0.91 DHPS (1.00) DHPS
SCHEMBL28570165 0.91 DHPS (1.00) DHPS
SCHEMBL30412277 0.91 DHPS (1.00) DHPS
SCHEMBL30410739 0.91 DHPS (1.00) DHPS
SCHEMBL30411983 0.91 DHPS (1.00) DHPS
SCHEMBL28578002 0.91 DHPS (1.00) DHPS
SCHEMBL28589605 0.90 DHPS (0.82) 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 3 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 claimed
CN-112778215-B 2-methoxyphenoxypyrimidine antitumor compound and preparation method and application thereof 中国医科大学 2023-06-20 CN disclosed
CN-112898208-B Phenylpyrimidine amine antitumor compound and preparation method and application thereof 中国医科大学 2023-06-20 CN disclosed