SCHEMBL27386972

SCHEMBL27386972

CCCc1ccc(CC(O)CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.45
LIPG Q9Y5X9 1/20 0.45
CYP3A4 P08684 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
TRPA1 O75762 1/20 0.41
ACACB O00763 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
PLK1 P53350 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
CA2 P00918 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GPR84 Q9NQS5 1/20 0.38

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
SCHEMBL27410645 0.80 LPL (0.50) LPLLIPGPPARGPPARAACACB
SCHEMBL8744446 0.79 LPL (0.45) LPLLIPGPPARGPPARATRPA1
SCHEMBL7476104 0.79 CYP3A4 (0.43) CYP3A4PPARGPPARATRPA1TRPV1
SCHEMBL5936696 0.78 CYP3A4 (0.46) CYP3A4PPARGPPARATRPA1ACACB
SCHEMBL8534643 0.78 LPL (0.48) LPLLIPGPPARGPPARATRPA1
SCHEMBL8746241 0.78 CYP3A4 (0.48) CYP3A4PPARGPPARATRPA1TRPV1
Glycerin SCHEMBL27485072 0.78 TDP1 (0.46) LPLLIPGTRPA1SIGMAR1
SCHEMBL28297690 0.76 ESR1 (0.43) CYP3A4TRPA1TRPV1
SCHEMBL13640085 0.76 KMT2A (0.61) KMT2A
SCHEMBL8470559 0.76 KMT2A (0.61) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1098155-C Composite barrier film and process for producing the same DAICEL CHEM (JP) 2003-01-08 CN disclosed
CN-1067941-C Barrier composite films and method for producing the same DAICEL CHEM (JP) 2001-07-04 CN disclosed
CN-1176173-A Barrier composite films and method for producing the same DAICEL CHEM (JP) 1998-03-18 CN disclosed
CN-1149854-A Composite barrier film and process for producing the same DAICEL CHEM (JP) 1997-05-14 CN disclosed