SCHEMBL21409490

SCHEMBL21409490

CCCCCOCC1CS1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.45
TSHR P16473 2/20 0.39
USP2 O75604 2/20 0.39
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
CES2 O00748 2/20 0.36
LPAR2 Q9HBW0 3/20 0.33
LPAR3 Q9UBY5 3/20 0.33

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
SCHEMBL2784940 0.98 ALDH1A1 (0.55) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL1402413 0.86 TSHR (0.42) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL5935738 0.79 ALDH1A1 (0.49) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL29239966 0.79 ALDH1A1 (0.49) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL15658951 0.79 SMN1; SMN2 (0.40) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL28920921 0.78 SMN1; SMN2 (0.50) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL1402632 0.78 TSHR (0.31) TSHR
SCHEMBL28914588 0.76 SMN1; SMN2 (0.32) ALDH1A1TDP1SMN1; SMN2TSHRUSP2
SCHEMBL4646300 0.76
SCHEMBL2734319 0.75 TSHR (0.72) ALDH1A1TDP1SMN1; SMN2TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868099-B Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2022-12-16 CN disclosed
CN-107428040-B Method for manufacturing plastic lens, method for positioning film, and composite body 株式会社HOPNIC研究所 2022-05-31 CN disclosed
CN-112469768-A Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2021-03-09 CN disclosed
CN-111868099-A Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2020-10-30 CN disclosed
CN-104903754-B Optical material, composition for optical material, and use thereof 三井化学株式会社 2020-05-22 CN disclosed
WO-2020022369-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2020-01-30 WO disclosed
WO-2019187176-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2019-10-03 WO disclosed