SCHEMBL4032283

SCHEMBL4032283

COC(=O)C(C(=O)C1CCCC(C(F)(F)F)C1)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
SLC6A3 Q01959 5/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A2 P23975 1/20 0.41
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL4021356 0.89 SLC6A3 (0.40) GAASMN1; SMN2HPGDSLC6A3SLC6A4
SCHEMBL4021827 0.86 SLC6A3 (0.42) GAASMN1; SMN2HPGDSLC6A3SLC6A4
SCHEMBL4022629 0.78 SLC6A3 (0.37) SLC6A3SLC6A4
SCHEMBL4024928 0.76 SLC6A3 (0.43) GAASMN1; SMN2HPGDSLC6A3SLC6A4
SCHEMBL4025663 0.75 DPP4 (0.38) SLC6A3SLC6A4KMT2A
SCHEMBL4022171 0.75 SLC6A3 (0.40) GAASMN1; SMN2HPGDSLC6A3SLC6A4
SCHEMBL4064082 0.71 ALDH1A1 (0.56) SMN1; SMN2SLC6A3SLC6A4SLC6A2RAB9A
SCHEMBL4021493 0.70 KDM4E (0.38) GAASMN1; SMN2HPGDSLC6A3MEN1
SCHEMBL4025010 0.69 MEN1 (0.49) SLC6A3SLC6A4SLC6A2RAB9AMEN1
SCHEMBL4707996 0.69 SLC6A3 (0.52) SLC6A3SLC6A4

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
WO-2009100403-A1 SUBSTITUTED ARYL PYRIMIDINONES NEUROGEN CORPORATION (US) 2009-08-13 WO disclosed
WO-2009100403-A1 SUBSTITUTED ARYL PYRIMIDINONES NEUROGEN CORPORATION (US) 2009-08-13 WO disclosed