SCHEMBL26908548

SCHEMBL26908548

CC(CO)(CO)CO.Cc1cc(-c2ccccc2)c(C=O)cc1C=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
TSHR P16473 1/20 0.37
PDCD1 Q15116 8/20 0.36
CD274 Q9NZQ7 8/20 0.36
ESR2 Q92731 1/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
PTGS1 P23219 1/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 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
SCHEMBL26908514 0.94 ALDH1A1 (0.37) ALDH1A1TSHRPDCD1CD274ESR2
SCHEMBL29818666 0.87 ALDH1A1 (0.47) ALDH1A1TSHRESR2MAPTHPGD
SCHEMBL26908564 0.86 ALDH1A1 (0.35) ALDH1A1TSHRPDCD1CD274ESR2
SCHEMBL27223012 0.82 GRIA1 (0.40) ALDH1A1TSHRNPC1RAB9APKM
SCHEMBL29818705 0.81 ALDH1A1 (0.47) ALDH1A1TSHRESR2MAPTHPGD
SCHEMBL26908608 0.81 ALDH1A1 (0.42) ALDH1A1TSHRNPC1RAB9APKM
SCHEMBL26908526 0.80 ALDH1A1 (0.35) ALDH1A1TSHRPDCD1CD274ESR2
SCHEMBL26908516 0.79 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL26908570 0.79 BACE1 (0.39) ALDH1A1ESR2MAPTKDM4EMEN1
Ortho-Phthalaldehyde SCHEMBL29080242 0.75 LMNA (0.56) ALDH1A1TSHRHPGDMEN1KMT2A

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