SCHEMBL29220229

SCHEMBL29220229

CCC=CCC(C(=O)OC(C)C)C(C)C(=O)OC(C)C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.34
GRIK2 Q13002 2/20 0.34
TSHR P16473 1/20 0.31
LMNA P02545 2/20 0.31
FPR2 P25090 1/20 0.30
NR1I2 O75469 1/20 0.30
PGR P06401 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
PTGS2 P35354 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL29220235 0.90 GRIK1 (0.39) GRIK1GRIK2FPR2
SCHEMBL27736984 0.84 GRIK1 (0.33) GRIK1GRIK2TSHRLMNA
SCHEMBL29220139 0.80 GRIK1 (0.35) GRIK1GRIK2TSHRFPR2NR1I2
SCHEMBL29220395 0.80 NR1I2 (0.38) GRIK1GRIK2TSHRLMNAFPR2
SCHEMBL29220259 0.77 HCAR2 (0.34) GRIK1GRIK2
SCHEMBL29220143 0.77 TSHR (0.39) GRIK1GRIK2TSHRNR1I2PGR
SCHEMBL8980120 0.77 TSHR (0.39) TSHRLMNA
SCHEMBL4789138 0.75 GRIK1 (0.41) GRIK1GRIK2FPR2NR1I2PGR
SCHEMBL29220253 0.75 ATM (0.42) GRIK1GRIK2TSHR
SCHEMBL27736978 0.74 GRIK1 (0.38) GRIK1GRIK2TSHRLMNA

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