SCHEMBL2787293

SCHEMBL2787293

C=C(C)C(=O)OCCOc1ccccc1-c1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
JAK2 O60674 1/20 0.44
GAA P10253 1/20 0.44
THRB P10828 2/20 0.41
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 6/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
POLB P06746 2/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL1938350 0.93 THRB (0.46) LMNATHRBALDH1A1KDM4ESMN1; SMN2
SCHEMBL4580084 0.88 GAA (0.58) LMNAMAPTJAK2GAATHRB
SCHEMBL10580556 0.85 THRB (0.50) LMNAMAPTJAK2GAATHRB
SCHEMBL29550232 0.84 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL7524394 0.84 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2TDP1HTT
SCHEMBL4578031 0.84 THRB (0.44) LMNAMAPTJAK2GAATHRB
SCHEMBL2337516 0.82 MTNR1A (0.43) LMNAALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL10646027 0.81 GAA (0.51) LMNAMAPTJAK2GAATHRB
SCHEMBL25123525 0.81 ALDH1A1 (0.60) LMNAALDH1A1KDM4ESMN1; SMN2TDP1
SCHEMBL25796435 0.81 ALDH1A1 (0.60) LMNAALDH1A1KDM4ESMN1; SMN2TDP1

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
WO-2010027676-A2 DENTAL COMPOSITION COMPRISING BIPHENYL DI(METH)ACRYLATE MONOMER 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-03-11 WO disclosed