SCHEMBL8526433

SCHEMBL8526433

O=C[C@H](Oc1ccccc1)[C@@H](O)[C@H](O)[C@H](O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.38
PPARA Q07869 14/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2D6 P10635 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL12500584 0.81 KDM4E (0.42) PPARGPPARACYP1A2CYP2C19GAA
SCHEMBL2786997 0.81 KMT2A (0.40) GAAPKM
SCHEMBL4511952 0.81 PPARG (0.36) PPARGPPARACYP1A2CYP2C9CYP2C19
SCHEMBL1377219 0.79 LMNA (0.35) PPARGPPARAMTNR1AMTNR1B
SCHEMBL3512233 0.79 LMNA (0.35) PPARGPPARAMTNR1AMTNR1B
SCHEMBL5822045 0.79 LMNA (0.35) PPARGPPARAMTNR1AMTNR1B
SCHEMBL10399945 0.78 SMN1; SMN2 (0.45) HIF1A
SCHEMBL1871593 0.78 TSHR (0.54) CYP1A2CYP2C9CYP2C19HPGDHIF1A
SCHEMBL21195781 0.76 SLC1A1 (0.49) PPARGPPARACYP1A2CYP2C9CYP2C19
SCHEMBL4013345 0.75 KDM4E (0.39) GAAHPGDHSD17B10

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-0663959-B1 NOVEL CULTURE MEDIUM FOR THE ENUMERATION OF $i(E. COLI) AND METHOD OF USE RAMBACH ALAIN (FR) 1997-03-05 EP claimed
CN-108610386-B Preparation method of substituted benzyl or substituted phenyl beta-D-hexuronic acid glucoside 上海交通大学 2020-11-24 CN disclosed
US-5846761-A Culture medium for the detection of E. coli and process for its use RAMBACH ALAIN (FR) 1998-12-08 US disclosed