SCHEMBL20564477

SCHEMBL20564477

Cc1ccccc1C(CCCCCCC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.44
CYSLTR1 Q9Y271 2/20 0.44
HDAC3 O15379 2/20 0.44
HDAC4 P56524 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC7 Q8WUI4 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC9 Q9UKV0 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
TBXAS1 P24557 3/20 0.43
TBXA2R P21731 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PTGER1 P34995 1/20 0.40
PTGFR P43088 1/20 0.40

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
SCHEMBL20563775 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL7007322 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL14360149 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL20563923 0.98 CYSLTR2 (0.42) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL20564111 0.94 CYSLTR2 (0.46) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL29582890 0.88 TBXA2R (0.40) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL2566048 0.88 TBXA2R (0.40) CYSLTR2CYSLTR1HDAC3HDAC4HDAC1
SCHEMBL7980729 0.87 MMP2 (0.49) CYSLTR2CYSLTR1ALDH1A1MMP2MMP9
SCHEMBL11291328 0.86 CYSLTR2 (0.45) CYSLTR2CYSLTR1MAPTALDH1A1FFAR1
SCHEMBL11295816 0.86 CYSLTR2 (0.45) CYSLTR2CYSLTR1MAPTALDH1A1FFAR1

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