SCHEMBL28633442

SCHEMBL28633442

CCCCCOC(C=CCCCCCCCCCCC=O)OC(C=CCCCCCCCCCCC=O)OCCCCC

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.55
TRPV1 Q8NER1 2/20 0.55
TSHR P16473 2/20 0.50
ALDH1A1 P00352 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
S1PR4 O95977 2/20 0.39
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 2/20 0.39
S1PR5 Q9H228 2/20 0.39
S1PR2 O95136 1/20 0.39
TSPO P30536 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
SGPL1 O95470 3/20 0.39

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
SCHEMBL28631795 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28633517 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28646483 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28631865 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28651587 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28642557 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28634936 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28633220 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28632964 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1
SCHEMBL28644508 1.00 FAAH (0.55) FAAHTRPV1TSHRALDH1A1CNR1

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