SCHEMBL28980381

SCHEMBL28980381

CC1(C)OB(c2cc(F)c(C=CC(=O)O)c(F)c2)OC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.43
ROCK1 Q13464 1/20 0.39
LIPG Q9Y5X9 3/20 0.37
LPL P06858 2/20 0.37
F2 P00734 2/20 0.36
F11 P03951 2/20 0.36
PRSS1 P07477 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MIF P14174 1/20 0.36
CA1 P00915 5/20 0.34
CA2 P00918 5/20 0.34
CA9 Q16790 5/20 0.34
CA12 O43570 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 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
SCHEMBL29013532 1.00 P4HB (0.43) P4HBROCK1LIPGLPLF2
SCHEMBL19510886 0.81 CNKSR1 (0.41) P4HBROCK1CA1CA2CA9
SCHEMBL23122349 0.80 ALDH1A1 (0.57) P4HBALDH1A1SMN1; SMN2CA1CA2
SCHEMBL23124209 0.78 LPL (0.43) P4HBROCK1LIPGLPLF2
SCHEMBL26623515 0.77 P4HB (0.43) P4HBALDH1A1SMN1; SMN2MIFCA1
SCHEMBL12205633 0.76 ROCK1 (0.42) P4HBROCK1LIPGLPLF2
SCHEMBL19510624 0.76 CYP3A4 (0.36) P4HBROCK1CA1CA2CA9
SCHEMBL19510623 0.76 CYP3A4 (0.36) P4HBROCK1CA1CA2CA9
SCHEMBL25191462 0.75 P4HB (0.48) P4HBLIPGLPLF2F11
SCHEMBL22165435 0.75 LPL (0.41) P4HBROCK1LIPGLPLF2

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-115925679-A Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-07 CN disclosed