SCHEMBL7181027

SCHEMBL7181027

C=CC(=O)OCc1ccccc1[O]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.47
THRA P10827 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
TSHR P16473 6/20 0.38
ALDH1A1 P00352 4/20 0.38
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
CYP3A4 P08684 3/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.35
PPARG P37231 1/20 0.35
AKT1 P31749 1/20 0.34
CA12 O43570 1/20 0.34
AKR1B10 O60218 1/20 0.34
AKR1B1 P15121 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 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
SCHEMBL10451653 0.89 THRB (0.53) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL29577996 0.89 THRB (0.53) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL960201 0.82 IDO1 (0.48) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL1371361 0.82 THRB (0.47) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL9555275 0.82 THRB (0.47) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL2029842 0.81 THRB (0.46) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL961210 0.81 L3MBTL1 (0.50) THRBALDH1A1
SCHEMBL21913950 0.81 THRB (0.46) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL1591973 0.81 MAOB (0.46) THRBTHRATSHRALDH1A1LMNA
SCHEMBL33527978 0.81 THRB (0.46) THRBTHRAHCAR2TSHRALDH1A1

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
EP-1279720-A1 FLAME RETARDANT, FLAME-RETARDANT RESIN COMPOSITION, MOLDED OBJECT, AND ELECTRONIC PART OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-01-29 EP disclosed