SCHEMBL8944923

SCHEMBL8944923

C=COC(CC(=O)OC)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 4/20 0.34
HSD17B10 Q99714 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL10012399 0.82 TSHR (0.36) TSHRHSD17B10MGAMGAASI
SCHEMBL7772505 0.80 CA1 (0.38) ALDH1A1TSHRMGAMGAASI
SCHEMBL11542333 0.78 TSHR (0.40) ALDH1A1LMNATSHRHSD17B10MGAM
SCHEMBL17578508 0.78 ALDH1A1 (0.37) ALDH1A1LMNATSHRHSD17B10MGAM
SCHEMBL2648364 0.77 TSHR (0.42) LMNATSHRHSD17B10MGAMGAA
SCHEMBL5507844 0.77 TSHR (0.42) LMNATSHRHSD17B10MGAMGAA
SCHEMBL8945018 0.77 CA1 (0.40) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL8945064 0.77 ALDH1A1 (0.33) ALDH1A1LMNATSHR
SCHEMBL13955184 0.74 GRIK1 (0.32) MEN1KMT2A
SCHEMBL23323136 0.74 TSHR (0.39) LMNATSHRHSD17B10MGAMGAA

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
US-5520834-A VINYL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed