SCHEMBL29220396

SCHEMBL29220396

CCC=CCC(C(=O)O)C(C)C(=O)OCCCCC

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.41
NAAA Q02083 1/20 0.38
EPHX1 P07099 1/20 0.36
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
ATM Q13315 1/20 0.35
TSHR P16473 2/20 0.35
FAAH O00519 1/20 0.34

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
SCHEMBL29220257 0.95 ATM (0.40) HCAR2NAAAGRIK1GRIK2ATM
SCHEMBL29220392 0.91 NAAA (0.40) HCAR2NAAAEPHX1ATMTSHR
SCHEMBL29220261 0.89 GRIK1 (0.38) HCAR2GRIK1GRIK2
SCHEMBL27932829 0.87 HCAR2 (0.42) HCAR2NAAAEPHX1TSHR
SCHEMBL29220253 0.86 ATM (0.42) HCAR2NAAAGRIK1GRIK2ATM
SCHEMBL27737017 0.84 ATM (0.40) HCAR2GRIK1GRIK2ATMTSHR
SCHEMBL4789138 0.81 GRIK1 (0.41) GRIK1GRIK2
SCHEMBL29220147 0.80 GRIK1 (0.38) GRIK1GRIK2TSHR
SCHEMBL29220259 0.80 HCAR2 (0.34) HCAR2GRIK1GRIK2
SCHEMBL29220142 0.80 GRIK1 (0.40) GRIK1GRIK2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108888-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed
CN-118108888-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed