SCHEMBL11085289

SCHEMBL11085289

CCCCCC(CC)C(=O)CCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.53
MAPK1 P28482 1/20 0.53
FFAR4 Q5NUL3 2/20 0.52
FFAR1 O14842 2/20 0.52
AKR1B1 P15121 1/20 0.50
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48

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
SCHEMBL29052509 0.94 CA2 (0.61) CA2MAPK1FFAR4FFAR1AKR1B1
SCHEMBL9373538 0.89 FFAR4 (0.58) FFAR4FFAR1AKR1B1GPR84PPARG
SCHEMBL21302690 0.89 FFAR4 (0.56) CA2FFAR4FFAR1AKR1B1GPR84
SCHEMBL23177379 0.86 CA2 (0.54) CA2MAPK1FFAR4FFAR1AKR1B1
SCHEMBL8423880 0.86 CA2 (0.54) CA2MAPK1CA1
SCHEMBL9074791 0.84 CES2 (0.55) CA2MAPK1FFAR4FFAR1CA1
SCHEMBL28453988 0.84 CA2 (0.52) CA2MAPK1CA1
SCHEMBL28886256 0.82 CA2 (0.55) CA2MAPK1FFAR4FFAR1GPR84
SCHEMBL27479021 0.82 CA2 (0.50) CA2MAPK1FFAR4FFAR1AKR1B1
SCHEMBL13679327 0.82 CA2 (0.59) CA2MAPK1CA1

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
US-4489012-A PESTICIDES UNION CARBIDE CORPORATION (US) 1984-12-18 US disclosed
US-4409153-A MITICIDES, OVICIDES, HERBICIDES UNION CARBIDE CORPORATION (US) 1983-10-11 US disclosed