SCHEMBL8747683

SCHEMBL8747683

C=COC(=O)CCCCCCCCO

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.44
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
TSHR P16473 4/20 0.44
LMNA P02545 3/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
MAPT P10636 2/20 0.34
ABCC4 O15439 1/20 0.34
CNR2 P34972 1/20 0.33
DGKA P23743 1/20 0.33
MAPK1 P28482 1/20 0.33
CAMK2A Q9UQM7 1/20 0.32
CYP3A4 P08684 1/20 0.31

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
SCHEMBL10321212 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL10325174 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL10322566 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL8178445 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL8176796 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL8178199 1.00 GPR84 (0.44) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL9894019 0.98 TSHR (0.41) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL813444 0.91
Ethylene Glycol SCHEMBL21801572 0.91 TSHR (0.42) GPR84FFAR1FFAR4TSHRLMNA
SCHEMBL491650 0.91 TSHR (0.50) TSHRLMNAALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520281-B1 Optical element for generating short wave laser light HOFFMANN LA ROCHE (CH) 1997-03-12 EP disclosed
EP-0520281-A2 Optical element for generating short wave laser light F. HOFFMANN-LA ROCHE AG (CH) 1992-12-30 EP disclosed