SCHEMBL30953832

SCHEMBL30953832

CCCCCCC1(C)Oc2cc(C(F)(F)F)ccc2-c2nc(N)sc21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.34
SCN4A P35499 1/20 0.34
CNR1 P21554 3/20 0.34
CNR2 P34972 3/20 0.34
MPL P40238 2/20 0.32
TLR8 Q9NR97 2/20 0.31
PTGES O14684 4/20 0.31
PTGS1 P23219 1/20 0.31
MYC P01106 1/20 0.30
WDR5 P61964 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
SCHEMBL30953627 0.84 EPHX2 (0.34) EPHX2SCN4AMPLPTGESPTGS1
SCHEMBL30953758 0.83 EPHX2 (0.34) EPHX2SCN4AMPLPTGESPTGS1
SCHEMBL30953839 0.81 EPHX2 (0.42) EPHX2SCN4AMPLPTGESPTGS1
SCHEMBL30953678 0.80 EPHX2 (0.39) EPHX2SCN4AMPLPTGESMYC
SCHEMBL30953616 0.76 EPHX2 (0.40) EPHX2SCN4AMPLMYCWDR5
SCHEMBL30953779 0.76 EPHX2 (0.38) EPHX2SCN4AMPLPTGESPTGS1
SCHEMBL30953882 0.75 EPHX2 (0.37) EPHX2SCN4AMPLMYCWDR5
SCHEMBL30953589 0.75 EPHX2 (0.40) EPHX2SCN4AMPLPTGESPTGS1
SCHEMBL30953717 0.74 EPHX2 (0.40) EPHX2SCN4AMPLMYCWDR5
SCHEMBL30953683 0.73 EPHX2 (0.42) EPHX2SCN4AMPLMYCWDR5

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
WO-2024140431-A1 COMPOUNDS COMPRISING HETEROARYL RINGS AND COMPOSITIONS AND METHODS THEREOF IONGEN THERAPEUTICS CO., LTD. (CN) 2024-07-04 WO disclosed