SCHEMBL29953210

SCHEMBL29953210

OB(O)c1cc(F)ncc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ASPH Q12797 1/20 0.36
SYK P43405 1/20 0.31
AURKA O14965 1/20 0.31
KIF11 P52732 1/20 0.31
MAP4K4 O95819 1/20 0.30
MINK1 Q8N4C8 1/20 0.30
TNIK Q9UKE5 1/20 0.30
AR P10275 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
SCHEMBL29956331 0.85 ASPH (0.36) ASPHSYKAURKA
SCHEMBL29953406 0.79 PIK3CD (0.38) ASPH
SCHEMBL28486144 0.79 PIK3R1 (0.37) ASPH
SCHEMBL2561505 0.78 ASPH (0.32) ASPH
SCHEMBL16115971 0.77 MEN1 (0.41)
SCHEMBL29953242 0.77 MEN1 (0.41)
SCHEMBL29514284 0.75 VRK1 (0.32) ASPH
SCHEMBL26963672 0.75
SCHEMBL1192318 0.75 VRK1 (0.32) ASPH
SCHEMBL15051004 0.74 CYP3A4 (0.34)

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed