SCHEMBL28516981

SCHEMBL28516981

CCCCOB(O)OCCOCCO

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
THRB P10828 1/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 1/20 0.55
ALDH1A1 P00352 5/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
CASP1 P29466 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
ACHE P22303 1/20 0.32
EPHX2 P34913 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL28425705 1.00 TSHR (0.61) TSHRMEN1KMT2ATHRBHTT
SCHEMBL27909475 0.88 MEN1 (0.48) TSHRMEN1KMT2ATHRBHTT
SCHEMBL17333427 0.87 TSHR (0.52) TSHRMEN1KMT2ATHRBHTT
SCHEMBL28111288 0.85 MEN1 (0.50) TSHRMEN1KMT2ATHRBHTT
SCHEMBL28263543 0.85 MEN1 (0.50) TSHRMEN1KMT2ATHRBHTT
SCHEMBL28263539 0.85 MEN1 (0.50) TSHRMEN1KMT2ATHRBHTT
SCHEMBL17333144 0.83 TSHR (0.52) TSHRMEN1KMT2ATHRBHTT
Triethylene Glycol SCHEMBL28112719 0.83 TSHR (0.81) TSHRMEN1KMT2ATHRBHTT
SCHEMBL28921 0.82 TSHR (0.42) TSHRMEN1KMT2ATHRBHTT
SCHEMBL486852 0.82 TSHR (0.42) TSHRMEN1KMT2ATHRBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4556456-A1 PROCESS FOR MAKING ETHYLENE GLYCOLS AND ETHOXYLATES BASED ON NON-FOSSIL ENERGY BASF SE (DE) 2025-05-21 EP disclosed
CN-108931525-B Rapid identification of brake fluid 通用汽车环球科技运作有限责任公司 2021-02-09 CN disclosed