SCHEMBL28444085

SCHEMBL28444085

O=C(O)C(CC(F)(F)F)(CC(F)(F)F)CP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2239056 0.74 CYP4F2 (0.38) MEN1LMNAKMT2A
SCHEMBL3044700 0.73 MEN1 (0.35) MEN1LMNAHPGDTSHRBLM
SCHEMBL2701905 0.70
SCHEMBL5964597 0.70 ACLY (0.43) TSHRTDP1
SCHEMBL17331124 0.70 FDPS (0.41)
SCHEMBL2154821 0.68 PGK1 (0.33)
SCHEMBL4267678 0.67 FDPS (0.44)
SCHEMBL15549149 0.67 ANPEP (0.41)
SCHEMBL5792177 0.67 MEN1 (0.38) MEN1LMNATSHRKMT2A
SCHEMBL491169 0.66 MEN1 (0.41) MEN1LMNAHPGDTSHRBLM

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
CN-105576279-B Lithium secondary battery 麦克赛尔控股株式会社 2020-05-12 CN disclosed