SCHEMBL14804336

SCHEMBL14804336

CC1(C)OB(c2ccc(C3(c4ccc(B5OC(C)(C)C(C)(C)O5)cc4)Cc4ccccc4-c4ccccc4C3)cc2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPL P06858 12/20 0.50
LIPG Q9Y5X9 12/20 0.50
ROCK1 Q13464 1/20 0.39
P4HB P07237 1/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
CA12 O43570 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
F11 P03951 1/20 0.36
BACE1 P56817 1/20 0.34

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
SCHEMBL14804345 0.84 LIPG (0.41) LPLLIPGROCK1P4HBPRMT5
SCHEMBL14804356 0.80 LPL (0.51) LPLLIPGROCK1P4HBCA1
SCHEMBL14804359 0.78 LIPG (0.49) LPLLIPGP4HBPRMT5WDR77
SCHEMBL23198900 0.78 LPL (0.61) LPLLIPGP4HBCA1CA2
SCHEMBL14804361 0.78 LPL (0.61) LPLLIPGP4HBCA1CA2
SCHEMBL14804363 0.78 LPL (0.61) LPLLIPGP4HBCA1CA2
SCHEMBL623911 0.75 LPL (0.57) LPLLIPGP4HBCA1CA2
SCHEMBL14595522 0.75 LPL (0.45) LPLLIPGROCK1P4HBPRMT5
SCHEMBL18164696 0.74 LPL (0.47) LPLLIPGROCK1P4HBPRMT5
SCHEMBL29265 0.74 LPL (0.47) LPLLIPGROCK1PRMT5WDR77

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-20130075714-A1 POLYMER, POLYMER COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE SUMTOMO CHEMICAL COMPANY LIMITED (JP) 2013-03-28 US disclosed