SCHEMBL7767501

SCHEMBL7767501

O=C(O)CCCOCCCCCCCCCCCCO

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.65
FFAR1 O14842 2/20 0.65
FFAR4 Q5NUL3 2/20 0.65
CAMK2A Q9UQM7 1/20 0.56
GAA P10253 1/20 0.55
TSHR P16473 5/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.48
NFKB1 P19838 1/20 0.48
PMP22 Q01453 1/20 0.48
SLC22A6 Q4U2R8 2/20 0.43
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
PLA2G4B P0C869 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL3262578 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL7765618 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL7860967 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL8651891 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL28794545 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL25377120 0.95 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL6367323 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL18095273 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL6697760 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA
SCHEMBL6551117 0.95 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AGAA

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
EP-1099698-A1 Macrocyclic oxalactones ( dioxacycloalkan-ones ) and their use as perfumes PFW AROMA CHEMICALS B.V. (NL) 2001-05-16 EP disclosed