SCHEMBL20564134

SCHEMBL20564134

C=CC(C=C)(CCCCC(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 1/20 0.47
MAPT P10636 1/20 0.47
LMNA P02545 2/20 0.46
TSHR P16473 4/20 0.44
NFKB1 P19838 2/20 0.44
PMP22 Q01453 1/20 0.44
SLC22A6 Q4U2R8 2/20 0.40
GPR84 Q9NQS5 4/20 0.38
FFAR1 O14842 2/20 0.38
FFAR4 Q5NUL3 2/20 0.38
AKR1B1 P15121 1/20 0.38
CYP2D6 P10635 1/20 0.38
FOLH1 Q04609 1/20 0.38
PPARG P37231 5/20 0.37
PPARD Q03181 5/20 0.37
PPARA Q07869 5/20 0.37
HDAC11 Q96DB2 4/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37

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
SCHEMBL4166126 0.98 ABCC4 (0.50) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL3440807 0.98 ABCC4 (0.50) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL4157165 0.98 ABCC4 (0.50) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL2783596 0.98 ABCC4 (0.50) ABCC4MAPTLMNATSHRNFKB1
Adipic Acid SCHEMBL1326484 0.96 ABCC4 (0.47) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL3440764 0.94 ABCC4 (0.43) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL1907123 0.85 MEN1 (0.39) ABCC4MAPTLMNATSHRNFKB1
SCHEMBL10600265 0.79 CES2 (0.38) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL20563911 0.78 CES2 (0.41) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL4238222 0.78 CES2 (0.41) TSHRSLC22A6GPR84FFAR1FFAR4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3625283-B1 POLYESTER COPOLYMER AVANTIUM KNOWLEDGE CENTRE BV (NL) 2025-05-07 EP disclosed
US-11548980-B2 Polyester copolymer AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2023-01-10 US disclosed
US-20210139645-A1 Polyester Copolymer AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2021-05-13 US disclosed
EP-3625283-A1 POLYESTER COPOLYMER Avantium Knowledge Centre B.V. (NL) 2020-03-25 EP disclosed
WO-2018211132-A1 POLYESTER COPOLYMER AVANTIUM KNOWLEDGE CENTRE B.V. (NL) 2018-11-22 WO disclosed