SCHEMBL3405330

SCHEMBL3405330

CC1(C)OB(c2cnn(COCCO)c2)OC1(C)C

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.57
LPL P06858 7/20 0.33
LIPG Q9Y5X9 7/20 0.33
DGAT1 O75907 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
F11 P03951 1/20 0.31
KLKB1 P03952 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL27031982 0.88 FFAR1 (0.56) FFAR1LPLLIPGDGAT1F11
SCHEMBL98872 0.86 FFAR1 (0.53) FFAR1LPLLIPGDGAT1CA1
SCHEMBL29966774 0.86 FFAR1 (0.53) FFAR1LPLLIPGDGAT1CA1
SCHEMBL2746946 0.86 FFAR1 (0.53) FFAR1LPLLIPGDGAT1CA1
SCHEMBL24609489 0.84 FFAR1 (0.57) FFAR1LPLLIPGDGAT1CA1
SCHEMBL19002004 0.84 FFAR1 (0.51) FFAR1LPLLIPGDGAT1CA1
SCHEMBL19629502 0.84 FFAR1 (0.51) FFAR1LPLLIPGDGAT1CA1
SCHEMBL1869990 0.81 FFAR1 (0.60) FFAR1LPLLIPGDGAT1CA1
SCHEMBL20759 0.81 FFAR1 (0.64) FFAR1LPLLIPGDGAT1F11
SCHEMBL14788157 0.80 FFAR1 (0.58) FFAR1LPLLIPGDGAT1CA1

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-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed