SCHEMBL24355332

SCHEMBL24355332

Cc1cc(Cl)cc(C(F)(F)C(C)(C)O)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.39
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NR3C1 P04150 1/20 0.33
NR3C2 P08235 1/20 0.33
PDK2 Q15119 2/20 0.30
PDK1 Q15118 1/20 0.30
PDK3 Q15120 1/20 0.30
PDK4 Q16654 1/20 0.30

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
SCHEMBL19507024 0.79 MEN1 (0.38) RAPGEF4PGK1PGK2MEN1KMT2A
SCHEMBL22808889 0.79 RAPGEF4 (0.43) RAPGEF4PGK1PGK2NR3C1NR3C2
SCHEMBL902818 0.77 RAPGEF4 (0.58) RAPGEF4PGK1PGK2
SCHEMBL25112321 0.77 TSHR (0.46) PGK1PGK2
SCHEMBL19265367 0.76 RAPGEF4 (0.41) RAPGEF4PGK1PGK2NR3C1NR3C2
SCHEMBL8826911 0.74 POLB (0.41) RAPGEF4MEN1KMT2A
SCHEMBL24355295 0.74 PTPN1 (0.38) PGK1PGK2NR3C1NR3C2PDK2
SCHEMBL24355315 0.73 AR (0.33) PGK1PGK2PDK2PDK1PDK3
SCHEMBL16579376 0.71 RAPGEF4 (0.40) RAPGEF4
SCHEMBL22783306 0.71 RAPGEF4 (0.40) RAPGEF4PGK1PGK2

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
WO-2022083657-A1 SUBSTITUTED BENZO OR PYRIDOPYRIMIDINE AMINE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 苏州泽璟生物制药股份有限公司 2022-04-28 WO disclosed