SCHEMBL29111141

SCHEMBL29111141

CCCCCCOc1cc(O)ccc1CC(O)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.54
CNR1 P21554 8/20 0.54
NR5A1 Q13285 1/20 0.49
TYR P14679 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX5 P09917 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYSLTR2 Q9NS75 1/20 0.45
CYSLTR1 Q9Y271 1/20 0.45
LTA4H P09960 1/20 0.43

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
SCHEMBL9698367 0.83 CNR2 (0.62) CNR2CNR1NR5A1TYRMEN1
SCHEMBL11329254 0.78 SMPD1 (0.60) CNR2CNR1NR5A1TYRMEN1
SCHEMBL14557522 0.78 SMPD1 (0.60) CNR2CNR1NR5A1TYRMEN1
SCHEMBL11356391 0.76 CNR2 (0.50) CNR2CNR1NR5A1TYRMEN1
SCHEMBL17445869 0.76 NR5A1 (0.56) CNR2CNR1NR5A1TYRMEN1
SCHEMBL9699699 0.76 NR5A1 (0.56) CNR2CNR1NR5A1TYRMEN1
SCHEMBL30528065 0.76 SMPD1 (0.57) CNR2CNR1NR5A1TYRMEN1
SCHEMBL1405908 0.76 SMPD1 (0.57) CNR2CNR1NR5A1TYRMEN1
SCHEMBL9641086 0.75 THRA (0.54) CNR2CNR1NR5A1TYRMEN1
SCHEMBL9699832 0.75 NR5A1 (0.54) CNR2CNR1NR5A1TYRMEN1

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
CN-115698164-A Additive composition, resin composition containing same, method for producing same, and molded article 株式会社ADEKA 2023-02-03 CN disclosed