SCHEMBL11115586

SCHEMBL11115586

C=CCC(C)(Oc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.50
PPARA Q07869 6/20 0.50
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.42
MAPT P10636 2/20 0.41
ADORA3 P0DMS8 1/20 0.40
ELANE P08246 2/20 0.40
THRB P10828 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 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
SCHEMBL7087893 0.80 PPARG (0.57) PPARGPPARAMAPTADORA3ELANE
SCHEMBL1960387 0.79 PPARG (0.62) PPARGPPARAMAPTADORA3ELANE
SCHEMBL14977289 0.78 PPARG (0.43) PPARGPPARAALDH1A1TSHRADORA3
SCHEMBL8410179 0.78 ALDH1A1 (0.46) PPARGPPARAALDH1A1TSHRHTT
SCHEMBL8410467 0.78 ALDH1A1 (0.46) PPARGPPARAALDH1A1TSHRHTT
SCHEMBL10903534 0.78 ALDH1A1 (0.46) PPARGPPARAALDH1A1TSHRHTT
SCHEMBL3465228 0.77 PPARG (0.58) PPARGPPARAMAPTADORA3ELANE
SCHEMBL1811048 0.77 MAPT (0.47) PPARGPPARAALDH1A1TSHRHTT
SCHEMBL27722722 0.77 HTT (0.42) PPARGPPARAALDH1A1TSHRHTT
SCHEMBL2517199 0.77 PPARG (0.54) PPARGPPARAALDH1A1MAPTADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109750160-B Mixed extracting agent and method for separating rare earth yttrium 厦门稀土材料研究所 2020-12-01 CN claimed
CN-109750160-B Mixed extracting agent and method for separating rare earth yttrium 厦门稀土材料研究所 2020-12-01 CN disclosed
CN-109750160-B Mixed extracting agent and method for separating rare earth yttrium 厦门稀土材料研究所 2020-12-01 CN disclosed
CN-109750160-A Mixed extracting agent and method for separating rare earth yttrium 厦门稀土材料研究所 2019-05-14 CN disclosed
US-4465494-A FOR ENGINES OR BURNERS SOCIETE NATIONALE ELF AQUITAINE (FR) 1984-08-14 US disclosed
EP-0058605-A2 Microemulsion of water in a liquid combustible SOCIETE NATIONALE ELF AQUITAINE (FR) 1982-08-25 EP disclosed