SCHEMBL28683024

SCHEMBL28683024

CC(C)(C)OC(=O)N1CCC(C(F)(F)C(F)(F)F)C1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
RECQL P46063 1/20 0.44
EPHX1 P07099 1/20 0.44
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR119 Q8TDV5 4/20 0.42
PDE4B Q07343 1/20 0.41
NR1H2 P55055 1/20 0.41
KDM4E B2RXH2 1/20 0.41
THRB P10828 1/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41

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
SCHEMBL24113030 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL28994850 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL29890877 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL24766074 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL30540076 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL24766583 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL28850128 0.87 HPGD (0.49) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL28682790 0.86 HPGD (0.46) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL26666954 0.86 HPGD (0.46) HPGDRECQLEPHX1MAPTMEN1
SCHEMBL26666953 0.84 HPGD (0.43) HPGDRECQLEPHX1MAPTMEN1

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-2022060996-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2022-03-24 WO disclosed
CN-113874381-A Inhibitors of RAF kinase 金耐特生物制药公司 2021-12-31 CN disclosed