SCHEMBL8190055

SCHEMBL8190055

CCCc1ccc2c(c1)OC(F)(F)C(F)(F)O2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
LPL P06858 2/20 0.36
LIPG Q9Y5X9 2/20 0.36
KIF11 P52732 1/20 0.36
PDK2 Q15119 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
TRPA1 O75762 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
TRPV3 Q8NET8 1/20 0.35
TRPV4 Q9HBA0 1/20 0.35
TRPV2 Q9Y5S1 1/20 0.35
CETP P11597 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
MGLL Q99685 1/20 0.33
PTGS2 P35354 4/20 0.33
ALOX5 P09917 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL8367478 0.89 CNR1 (0.40) CNR1CNR2LPLLIPGKIF11
SCHEMBL2663547 0.85 PARP1 (0.40) KIF11PDK2ALOX15ALOX12TRPA1
SCHEMBL9589157 0.83 ALOX15 (0.50) CNR1CNR2LPLLIPGKIF11
SCHEMBL8119783 0.81 TAAR1 (0.53) KIF11ALOX15TAAR1MAPTGFER
SCHEMBL10911819 0.81 CNR1 (0.40) CNR1CNR2LPLLIPGPDK2
SCHEMBL27044834 0.79 SKP2 (0.42) CNR2LPLLIPGNPC1RAB9A
SCHEMBL6600310 0.79 CETP (0.39) KIF11ALOX15ALOX12TRPA1CETP
SCHEMBL26696493 0.77 KIF11 (0.37) KIF11ALOX15ALOX12CETP
SCHEMBL10769004 0.77 KIF11 (0.41) KIF11ALOX15ALOX12CETPTAAR1
SCHEMBL5752488 0.77 CETP (0.38) CNR2KIF11PDK2ALOX15ALOX12

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-2008063668-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-05-29 WO disclosed