SCHEMBL28600254

SCHEMBL28600254

CCCCCCC(C)OC(=O)C(O)CCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.55
FFAR1 O14842 3/20 0.51
FFAR4 Q5NUL3 2/20 0.51
GPR84 Q9NQS5 10/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
ALDH1A1 P00352 3/20 0.46
PPARG P37231 4/20 0.44
PPARD Q03181 4/20 0.44
PPARA Q07869 4/20 0.44
TSHR P16473 3/20 0.44
HDAC11 Q96DB2 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
TLR2 O60603 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
FABP4 P15090 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL15153946 0.82 TET2 (0.47) FAAHFFAR1FFAR4
SCHEMBL3320520 0.80 FAAH (0.65) FAAHFFAR1GPR84CNR1CNR2
SCHEMBL17560018 0.80 FAAH (0.65) FAAHFFAR1GPR84CNR1CNR2
SCHEMBL17560003 0.80 FAAH (0.65) FAAHFFAR1GPR84CNR1CNR2
SCHEMBL15154066 0.79 FFAR4 (0.49) FFAR1FFAR4GPR84ALDH1A1PPARG
SCHEMBL28562346 0.79 FAAH (0.58) FAAHFFAR1FFAR4GPR84CNR1
SCHEMBL17010718 0.79 NAAA (0.52) FFAR1FFAR4GPR84ALDH1A1PPARG
SCHEMBL29061012 0.79 FAAH (0.58) FAAHFFAR1FFAR4GPR84CNR1
SCHEMBL18280797 0.79 NAAA (0.52) FFAR1FFAR4GPR84ALDH1A1PPARG
SCHEMBL9249024 0.79 GPR84 (0.52) FAAHFFAR1GPR84CNR1CNR2

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-113082009-A Compositions and methods for treating aging and age-related diseases and conditions 加利福尼亚大学董事会 2021-07-09 CN disclosed