SCHEMBL1964322

SCHEMBL1964322

C=CC(=O)OC(CCCC)OCCC

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.49
HPGD P15428 1/20 0.49
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 4/20 0.36
ATM Q13315 1/20 0.35
THRA P10827 1/20 0.33
CTSK P43235 3/20 0.33
LMNA P02545 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 0.32
SMPD1 P17405 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
SCHEMBL29226608 0.95 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL29226799 0.94 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL29226801 0.94 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL29226700 0.94 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL29226703 0.92 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL2945054 0.90 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4THRB
Acrylic Acid SCHEMBL29267966 0.90 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4LMNA
SCHEMBL28463101 0.89 TSHR (0.41) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL29226613 0.88 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL9578994 0.88 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4THRB

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
CN-118165169-A Method for producing acrylic elastomer polymer, and polymer, rubber composition, vulcanized rubber and rubber enclosure 交通运输部科学研究院 2024-06-11 CN disclosed
WO-2011072227-A1 STRUCTURED SMUDGE-RESISTANT ANTI-REFLECTIVE COATINGS AND METHODS OF MAKING AND USING THE SAME NANO TERRA INC. (US) 2011-06-16 WO disclosed