SCHEMBL28375583

SCHEMBL28375583

CCC1OC(=O)CCC(=O)OC1CC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
CYP1A2 P05177 2/20 0.39
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PRKCA P17252 6/20 0.33
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 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
SCHEMBL28371484 0.86 CA1 (0.41) CA1CA9CYP1A2TSHRSMN1; SMN2
SCHEMBL28750061 0.81 CA1 (0.44) CA1CA9CYP1A2TSHRSMN1; SMN2
SCHEMBL12628457 0.80 CA1 (0.45) CA1CA9CYP1A2SMN1; SMN2PRKCA
SCHEMBL21010838 0.80 CA1 (0.45) CA1CA9CYP1A2SMN1; SMN2PRKCA
SCHEMBL13355820 0.80 CA1 (0.50) CA1CA9CYP1A2SMN1; SMN2PRKCA
SCHEMBL8348173 0.78 CA1 (0.43) CA1CA9CYP1A2PRKCA
SCHEMBL1070559 0.75
SCHEMBL22317231 0.75 KAT2A (0.36)
SCHEMBL194050 0.75
SCHEMBL193853 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110950985-B Catalyst component for olefin polymerization, catalyst and olefin polymerization method 中国石油化工股份有限公司 2022-01-04 CN claimed
CN-110950830-A Cyclic compound and preparation method and application thereof 中国石油化工股份有限公司 2020-04-03 CN claimed
CN-110950985-A Catalyst component for olefin polymerization, catalyst and olefin polymerization method 中国石油化工股份有限公司 2020-04-03 CN claimed
CN-110950985-B Catalyst component for olefin polymerization, catalyst and olefin polymerization method 中国石油化工股份有限公司 2022-01-04 CN disclosed
CN-110950830-A Cyclic compound and preparation method and application thereof 中国石油化工股份有限公司 2020-04-03 CN disclosed
CN-110950985-A Catalyst component for olefin polymerization, catalyst and olefin polymerization method 中国石油化工股份有限公司 2020-04-03 CN disclosed