SCHEMBL28640410

SCHEMBL28640410

CCOC(C=CCCCCCCCCCCC=O)OC(C=CCCCCCCCCCCC=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.47
TRPV1 Q8NER1 2/20 0.47
TSHR P16473 2/20 0.42
MAPT P10636 3/20 0.39
SGPL1 O95470 4/20 0.33
S1PR4 O95977 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
S1PR5 Q9H228 2/20 0.33
CYP3A4 P08684 2/20 0.33
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
S1PR2 O95136 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSPO P30536 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 2/20 0.32

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
SCHEMBL28631222 1.00 FAAH (0.47) FAAHTRPV1TSHRMAPTSGPL1
SCHEMBL28638718 1.00 FAAH (0.47) FAAHTRPV1TSHRMAPTSGPL1
SCHEMBL28642606 0.95 MAPT (0.43) FAAHTRPV1TSHRMAPTALDH1A1
SCHEMBL28631772 0.86 FAAH (0.48) FAAHTRPV1TSHRMAPTSGPL1
SCHEMBL28633133 0.86 FAAH (0.48) FAAHTRPV1TSHRMAPTSGPL1
SCHEMBL28633014 0.86 FAAH (0.48) FAAHTRPV1TSHRMAPTSGPL1
SCHEMBL28645625 0.85 FAAH (0.52) FAAHTRPV1TSHRSGPL1S1PR4
SCHEMBL28642705 0.85 FAAH (0.52) FAAHTRPV1TSHRSGPL1S1PR4
SCHEMBL28652175 0.85 FAAH (0.52) FAAHTRPV1TSHRSGPL1S1PR4
SCHEMBL28631795 0.83 FAAH (0.55) FAAHTRPV1TSHRSGPL1S1PR4

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
CN-113443971-A Method for producing alkynylalkoxymethyl ether compound and method for producing conjugated diene compound therefrom 信越化学工业株式会社 2021-09-28 CN disclosed