SCHEMBL30366247

SCHEMBL30366247

CCCCOC(O)(COCCOCCO)OCCCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
THRB P10828 1/20 0.52
HTT P42858 1/20 0.52
MAPT P10636 1/20 0.52
ALDH1A1 P00352 4/20 0.40
MAPK1 P28482 2/20 0.40
CYP3A4 P08684 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CASP1 P29466 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
SLCO1B1 Q9Y6L6 1/20 0.40
CES1 P23141 1/20 0.37
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
EPHX2 P34913 1/20 0.30
ACHE P22303 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
SCHEMBL6362864 1.00 TSHR (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL9637020 0.96 TSHR (0.56) TSHRMEN1KMT2ATHRBHTT
SCHEMBL7066435 0.86 CES1 (0.47) TSHRMEN1KMT2ATHRBHTT
SCHEMBL6759981 0.84 CES1 (0.46) TSHRMEN1KMT2ATHRBHTT
SCHEMBL9638125 0.80 TSHR (0.38) TSHRMEN1KMT2ATHRBHTT
SCHEMBL8814067 0.78 ALDH1A1 (0.50) TSHRMEN1KMT2ATHRBHTT
SCHEMBL23794957 0.77 TSHR (0.94) TSHRMEN1KMT2ATHRBHTT
SCHEMBL15619 0.77 TSHR (0.94) TSHRMEN1KMT2ATHRBHTT
Butoxyethanol SCHEMBL517874 0.77 TSHR (0.94) TSHRMEN1KMT2ATHRBHTT
SCHEMBL8639434 0.77 TSHR (0.94) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023054952-A1 SOLVENTLESS QUANTUM DOT COMPOSITION, METHOD FOR PRODUCING SAME, AND CURED FILM, COLOR FILTER, AND DISPLAY DEVICE COMPRISING SAME 주식회사 한솔케미칼 2023-04-06 WO disclosed