SCHEMBL21409503

SCHEMBL21409503

CC(C)CCCOCC1CS1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GBA1 P04062 1/20 0.30
LMNA P02545 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
SCHEMBL1402885 0.83 USP2 (0.30) TSHRUSP2ALDH1A1POLBALOX15
SCHEMBL1402483 0.80 TSHR (0.39) TSHRUSP2ALDH1A1POLBALOX15
SCHEMBL1402726 0.80 TSHR (0.44) TSHRUSP2ALDH1A1POLBALOX15
SCHEMBL1402413 0.78 TSHR (0.42) TSHRUSP2ALDH1A1POLBALOX15
SCHEMBL1402458 0.78 TSHR (0.31) TSHR
SCHEMBL22129866 0.78 TSHR (0.31) TSHR
SCHEMBL131809 0.77 GBA1 (0.33) TSHRALDH1A1SMN1; SMN2GBA1LMNA
SCHEMBL21409490 0.75 ALDH1A1 (0.52) TSHRUSP2ALDH1A1POLBALOX15
SCHEMBL1402632 0.75 TSHR (0.31) TSHR
SCHEMBL1402624 0.74

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