SCHEMBL16096504

SCHEMBL16096504

CCOCCOCc1c(F)cc(OCCOCC)cc1B(O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.36
▸ NCF1 P14598 2/20 0.33
▸ RARA P10276 1/20 0.32
▸ RARB P10826 1/20 0.32
▸ THRA P10827 1/20 0.32
▸ APP P05067 1/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TAAR1 Q96RJ0 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
SCHEMBL16097477 0.83 L3MBTL1 (0.35) FFAR1NCF1THRAAPPMEN1
SCHEMBL16098001 0.82 FFAR1 (0.35) FFAR1NCF1RARARARBTHRA
SCHEMBL23264578 0.72 NCF1 (0.42) NCF1THRAAPPMEN1KMT2A
SCHEMBL15219240 0.70 NCF1 (0.49) NCF1THRAAPPMEN1KMT2A
SCHEMBL3631805 0.69 NCF1 (0.41) FFAR1NCF1THRAAPPMEN1
SCHEMBL14268008 0.68 NCF1 (0.37) FFAR1NCF1RARARARBTHRA
SCHEMBL8259924 0.67 NCF1 (0.49) FFAR1NCF1RARARARBTHRA
SCHEMBL17311319 0.67 LMNA (0.32) —
SCHEMBL18418723 0.66 KDM4E (0.41) FFAR1RARARARBAPPTAAR1
SCHEMBL2556120 0.66 L3MBTL1 (0.41) NCF1MEN1KMT2A

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
EP-2970339-A1 1 -HYDROXY-BENZOOXABOROLES AS ANTIPARASITIC AGENTS Eli Lilly and Company (US) 2016-01-20 — — EP disclosed
WO-2014149793-A1 1 -HYDROXY-BENZOOXABOROLES AS ANTIPARASITIC AGENTS ELI LILLY AND COMPANY (US) 2014-09-25 — — WO disclosed
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