SCHEMBL28574121

SCHEMBL28574121

[Mg+2].[O-]CCCCCCO.[O-]CCCCCCO

nearest known ligand 0.42

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.37
GPR84 Q9NQS5 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MIF P14174 1/20 0.32

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
SCHEMBL28581463 1.00 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1
Lithium Ion SCHEMBL30497964 0.93 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1
Potassium Ion SCHEMBL30497961 0.93 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1
SCHEMBL30497980 0.93 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1
Lithium Ion SCHEMBL30497977 0.93
Potassium Ion SCHEMBL30497995 0.93
SCHEMBL30497974 0.93
Potassium Ion SCHEMBL30497960 0.93
SCHEMBL2178260 0.93 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1
Lithium Ion SCHEMBL30497988 0.93 LMNA (0.42) LMNAALDH1A1TSHRHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108602912-B Preactivated catalyst components for the polymerization of olefins 巴塞尔聚烯烃股份有限公司 2021-06-11 CN disclosed