SCHEMBL28355703

SCHEMBL28355703

CCCCCc1ccc(-c2ccccc2)c(F)c1B(O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 7/20 0.49
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
ALOX5 P09917 1/20 0.38
TYR P14679 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RARB P10826 1/20 0.37
HSD11B1 P28845 1/20 0.37
GCGR P47871 2/20 0.36
LPL P06858 6/20 0.36
PPARA Q07869 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
MGLL Q99685 1/20 0.36
ELANE P08246 1/20 0.35

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
SCHEMBL28359936 0.90 CTSL (0.36) LIPGLPLPPARAMGLLELANE
SCHEMBL28359990 0.89 LIPG (0.49) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL29287566 0.84 LIPG (0.43) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL7788940 0.82 HSD11B1 (0.42) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL28888671 0.82 LIPG (0.50) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL28361635 0.81 LIPG (0.57) LIPGALOX5GCGRLPLPPARA
SCHEMBL30002594 0.81 LIPG (0.57) LIPGALOX5GCGRLPLPPARA
SCHEMBL7781693 0.81 LIPG (0.44) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL7786742 0.81 LIPG (0.44) LIPGCYP3A4MAPTMEN1TP53
SCHEMBL9496996 0.80 HSD11B1 (0.43) LIPGCYP3A4MAPTMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110790641-B Method for producing compound having oxydifluoromethylene skeleton 大金工业株式会社 2023-02-28 CN disclosed
CN-110776927-B Isothiocyano fluorine-containing tetrabiphenyl liquid crystal compound, preparation method thereof, liquid crystal composition and application 武汉轻工大学 2021-09-17 CN disclosed
CN-106132915-B Method for producing compound having oxydifluoromethylene skeleton 大金工业株式会社 2020-03-31 CN disclosed
CN-110790641-A Method for producing compound having oxydifluoromethylene skeleton 大金工业株式会社 2020-02-14 CN disclosed
CN-110776927-A Isothiocyano fluorine-containing tetrabiphenyl liquid crystal compound, preparation method thereof, liquid crystal composition and application 武汉轻工大学 2020-02-11 CN disclosed