SCHEMBL29138962

SCHEMBL29138962

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.47
FFAR1 O14842 2/20 0.47
TSHR P16473 5/20 0.46
LMNA P02545 1/20 0.46
NFKB1 P19838 1/20 0.46
PMP22 Q01453 1/20 0.46
ALDH1A1 P00352 3/20 0.46
GSTK1 Q9Y2Q3 1/20 0.44
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 6/20 0.43
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
PTPN1 P18031 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL27998378 1.00 FFAR4 (0.47) FFAR4FFAR1TSHRLMNANFKB1
SCHEMBL11727672 1.00 FFAR4 (0.47) FFAR4FFAR1TSHRLMNANFKB1
SCHEMBL7162252 0.98 FFAR4 (0.44) FFAR4FFAR1TSHRLMNANFKB1
SCHEMBL9540341 0.92 GABRP (0.40) FFAR4FFAR1TSHRLMNANFKB1
Decanoic Acid SCHEMBL27380724 0.86 GPR84 (0.57) FFAR4FFAR1TSHRLMNAALDH1A1
SCHEMBL28196824 0.85 FFAR4 (0.47) FFAR4FFAR1TSHRLMNANFKB1
SCHEMBL19717 0.84 GABRP (0.48) TSHRNFKB1MEN1KMT2A
SCHEMBL3731166 0.82 ACE2 (0.48) FFAR4FFAR1GPR84PPARD
SCHEMBL6569983 0.82 ACE2 (0.48) FFAR4FFAR1GPR84PPARD
SCHEMBL11668063 0.82 ACE2 (0.48) FFAR4FFAR1GPR84PPARD

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-218741902-U Continuous reaction device for carboxylic ester intermediate 武汉青江化工黄冈有限公司 2023-03-28 CN disclosed