SCHEMBL7789321

SCHEMBL7789321

CCCCCCCCCc1ccc(-c2ccc(B(O)O)c(F)c2F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 5/20 0.54
▸ LPL P06858 4/20 0.54
▸ TRPV1 Q8NER1 1/20 0.54
▸ MGLL Q99685 1/20 0.54
▸ RARB P10826 9/20 0.52
▸ ESR1 P03372 2/20 0.46
▸ ADRA2A P08913 2/20 0.46
▸ ADORA3 P0DMS8 2/20 0.46
▸ TACR2 P21452 2/20 0.46
▸ SLC6A2 P23975 2/20 0.46
▸ SLC6A4 P31645 2/20 0.46
▸ SLC6A3 Q01959 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SHBG P04278 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ HSPD1 P10809 1/20 0.46

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
SCHEMBL7786816 1.00 LIPG (0.54) LIPGLPLTRPV1MGLLRARB
SCHEMBL7764726 0.99 LPL (0.53) LIPGLPLTRPV1MGLLRARB
SCHEMBL29950872 0.99 LPL (0.53) LIPGLPLTRPV1MGLLRARB
SCHEMBL16572151 0.94 CA1 (0.51) LIPGLPLTRPV1MGLLRARB
SCHEMBL2910682 0.88 LPL (0.49) LIPGLPLTRPV1MGLLRARB
SCHEMBL9493995 0.88 RARB (0.58) LIPGLPLRARBESR1ADRA2A
SCHEMBL9493483 0.88 RARB (0.58) LIPGLPLRARBESR1ADRA2A
SCHEMBL9493565 0.88 RARB (0.58) LIPGLPLRARBESR1ADRA2A
SCHEMBL9495900 0.88 RARB (0.58) LIPGLPLRARBESR1ADRA2A
SCHEMBL9494662 0.88 RARB (0.58) LIPGLPLRARBESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144546-A3 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2002-08-28 — — EP disclosed
EP-1144546-A2 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2001-10-17 — — EP disclosed
WO-2000004111-A2 FLUORINATED TERPHENYLS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-01-27 — — WO disclosed
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