SCHEMBL15965493

SCHEMBL15965493

CCOC(=O)c1cc(N(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)ccc1OCCOCCOCCOC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.34
▸ UCHL1 P09936 1/20 0.33
▸ HIF1A Q16665 2/20 0.33
▸ FDPS P14324 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ LMNA P02545 3/20 0.32
▸ LIPG Q9Y5X9 2/20 0.32
▸ LPL P06858 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ AAK1 Q2M2I8 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA9 Q16790 1/20 0.31

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
SCHEMBL15965492 0.86 FDPS (0.32) FDPSMAPTLMNAPOLBALDH1A1
SCHEMBL15965483 0.84 ALDH1A1 (0.40) FDPSMAPTLMNAPOLBALDH1A1
SCHEMBL15965484 0.83 HTT (0.39) FDPSMAPTLMNAPOLBALDH1A1
SCHEMBL15965494 0.83 ALDH1A1 (0.43) FDPSMAPTLMNAPOLBALDH1A1
SCHEMBL15965487 0.82 MAPK1 (0.40) FDPSMAPTLMNAALDH1A1HTT
SCHEMBL15965486 0.82 FDPS (0.37) FDPSMAPTLMNAPOLBALDH1A1
SCHEMBL564183 0.81 HIF1A (0.33) DGAT1UCHL1HIF1AFDPSAAK1
SCHEMBL14929194 0.81 HIF1A (0.33) DGAT1UCHL1HIF1AFDPSAAK1
SCHEMBL15965488 0.80 ALDH1A1 (0.40) MAPTLMNAPOLBALDH1A1HTT
SCHEMBL15965491 0.79 MAPT (0.44) MAPTLMNAPOLBALDH1A1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 — — US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 — — US disclosed
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