SCHEMBL7303389

SCHEMBL7303389

COc1ccccc1Oc1c(Cl)nc(-c2ccccc2)nc1Cl

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHPS P49366 17/20 0.81
LMNA P02545 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL28589605 0.91 DHPS (0.82) DHPS
SCHEMBL30410967 0.90 DHPS (1.00) DHPS
SCHEMBL28573132 0.90 DHPS (1.00) DHPS
SCHEMBL7293762 0.89 DHPS (0.82) DHPSLMNAHTTALDH1A1MAPT
SCHEMBL28581580 0.89 DHPS (0.82) DHPS
SCHEMBL4071996 0.89 DHPS (0.67) DHPSGAA
SCHEMBL28584053 0.89 DHPS (0.82) DHPSLMNA
SCHEMBL28916573 0.88 DHPS (0.83) DHPS
SCHEMBL28577446 0.87 DHPS (0.83) DHPSMEN1KMT2AMAPT
SCHEMBL5039384 0.86 DHPS (0.62) 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 10 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-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-A Phenyl pyrimidinamine antitumor compound and preparation method and application thereof 中国医科大学 2021-06-04 CN disclosed
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
EP-0526708-B1 Sulfonamide, preparation and use thereof as medicine and intermediate HOFFMANN LA ROCHE (CH) 2000-10-18 EP disclosed
EP-0633259-B1 Sulfonylaminopyrimidines, their preparation and their use as medicine HOFFMANN LA ROCHE (CH) 1999-01-13 EP disclosed
US-5541186-A ENDOTHELIN RECEPTOR INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1996-07-30 US disclosed
EP-0633259-A1 Sulfonylaminopyrimidines, their preparation and their use as medicine F. HOFFMANN-LA ROCHE AG (CH) 1995-01-11 EP disclosed
US-5292740-A Sulfonamides HOFFMANN-LA ROCHE INC. (US) 1994-03-08 US disclosed
EP-0526708-A1 Sulfonamide, preparation and use thereof as medicine and intermediate F. HOFFMANN-LA ROCHE AG (CH) 1993-02-10 EP disclosed