SCHEMBL27521069

SCHEMBL27521069

CCCCCCCCCCCCCCCCCCCCC(C(=O)O)C(=O)OCC

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.53
FFAR1 O14842 2/20 0.53
MAPT P10636 2/20 0.52
LCK P06239 1/20 0.52
PPARD Q03181 1/20 0.52
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
ACE2 Q9BYF1 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
ZDHHC7 Q9NXF8 1/20 0.47
GRIK1 P39086 1/20 0.44
GRIK2 Q13002 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL1653785 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9694469 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7744050 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1342413 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8979832 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28259406 0.98 GPR84 (0.50) GPR84FFAR1MAPTLCKPPARD
Chloroform SCHEMBL17317224 0.94 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1292730 0.92 TDP1 (0.50) GPR84FFAR1MAPTLCKPPARD
SCHEMBL10017368 0.92 TDP1 (0.50) GPR84FFAR1MAPTLCKPPARD
SCHEMBL182928 0.92 TDP1 (0.50) GPR84FFAR1MAPTLCKPPARD

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
CN-1273127-C Perfume composition SHISEIDO CO LTD (JP) 2006-09-06 CN disclosed
CN-1538840-A Perfume composition ������������ʽ���� 2004-10-20 CN disclosed