SCHEMBL28010053

SCHEMBL28010053

[CH2]C1(C2CCCC2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL28090707 1.00 LMNA (0.30) LMNATSHRKDM4EMAPT
SCHEMBL3557472 0.97 LMNA (0.31) LMNATSHRKDM4EMAPT
SCHEMBL6723236 0.95
SCHEMBL6586892 0.94 LMNA (0.30) LMNATSHRKDM4EMAPT
SCHEMBL17048858 0.92
SCHEMBL6591481 0.88
SCHEMBL17048978 0.83
SCHEMBL17049022 0.82
SCHEMBL28216756 0.81
SCHEMBL6591813 0.80

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
CN-115424682-A Ethylene oligomerization catalyst molecule design method based on machine learning 华东理工大学 2022-12-02 CN claimed
CN-104511311-B A kind of ethylene trimer of high selectivity, four poly- catalyst systems and its application method 华东理工大学 2017-07-07 CN claimed
CN-104511311-A High-selectivity catalyst system used in trimerization and tetramerization of ethylene and use method thereof UNIV EAST CHINA SCIENCE & TECH 2015-04-15 CN claimed
CN-115424682-A Ethylene oligomerization catalyst molecule design method based on machine learning 华东理工大学 2022-12-02 CN disclosed
CN-104511311-A High-selectivity catalyst system used in trimerization and tetramerization of ethylene and use method thereof UNIV EAST CHINA SCIENCE & TECH 2015-04-15 CN disclosed