SCHEMBL26908554

SCHEMBL26908554

CC(CO)(CO)CO.Cc1c(C=O)ccc(C=O)c1C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 2/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
ERN1 O75460 1/20 0.34
SRC P12931 1/20 0.33
TYR P14679 2/20 0.32
TRIM24 O15164 2/20 0.32
TRIM33 Q9UPN9 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL26908615 0.86 ALDH1A1 (0.33) KCNJ1ALDH1A1TSHR
SCHEMBL26908512 0.84 CA1 (0.44) KCNJ1ALDH1A1TSHRERN1SRC
SCHEMBL29080245 0.82 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL29080238 0.81 SRC (0.47) ALDH1A1ERN1SRCTYRTRIM24
Ortho-Phthalaldehyde SCHEMBL29080242 0.81 LMNA (0.56) ALDH1A1TSHRERN1SRCTRIM24
SCHEMBL26908605 0.81 ERN1 (0.39) ALDH1A1TSHRERN1TYRTRIM24
SCHEMBL26908577 0.80 KCNJ1 (0.34) KCNJ1ALDH1A1TSHRERN1SRC
SCHEMBL29080259 0.79 ERN1 (0.39) ALDH1A1TSHRERN1SRC
SCHEMBL26908608 0.79 ALDH1A1 (0.42) KCNJ1ALDH1A1TSHRERN1SRC
SCHEMBL29818681 0.79 ALDH1A1 (0.50) KCNJ1ALDH1A1TSHRERN1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166867-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-05-23 US disclosed
EP-4286448-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-12-06 EP disclosed
CN-116940559-A Cyclic diol compound, process for producing the compound, and use of the compound 新日本理化株式会社 2023-10-24 CN disclosed
CN-116829618-A Thermoplastic resin and optical lens comprising the same 三菱瓦斯化学株式会社 2023-09-29 CN disclosed