SCHEMBL5157960

SCHEMBL5157960

C[C@H](Nc1nc(OC(=O)NC(C)(C)C)nc(Cl)c1-c1c(F)cc(F)cc1F)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.31
POLB P06746 1/20 0.30
APEX1 P27695 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
SCHEMBL5154886 0.89
SCHEMBL5158021 0.88 SCN9A (0.31)
SCHEMBL5109023 0.83 POLB (0.36) POLBAPEX1
SCHEMBL14000735 0.82 IDH1 (0.31)
SCHEMBL14000727 0.79 HTT (0.33)
SCHEMBL5101875 0.78 MDM2 (0.35)
SCHEMBL14561497 0.78 IDH1 (0.31)
SCHEMBL5109371 0.78 MAPK1 (0.33) POLB
SCHEMBL5098995 0.77 MAPT (0.30)
SCHEMBL5140205 0.75 RORC (0.30)

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
EP-1651618-B1 2-SUBSTITUTED PYRIMIDINES BASF AG (DE) 2007-01-03 EP disclosed
EP-1651618-A1 2-SUBSTITUTED PYRIMIDINES BASF AKTIENGESELLSCHAFT (DE) 2006-05-03 EP disclosed
WO-2005012261-A1 2-SUBSTITUTED PYRIMIDINES BASF AKTIENGESELLSCHAFT (DE) 2005-02-10 WO disclosed