SCHEMBL29236397

SCHEMBL29236397

CCOC(=O)c1cc(S(=O)(=O)c2ccccc2)cc2sc3ccccc3c(=O)c12.COCCOCCOC(=O)c1ccc2c(=O)c3ccccc3sc2c1C(=O)OCCOCCOC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.36
ALDH1A1 P00352 2/20 0.36
USP2 O75604 1/20 0.36
KDM4E B2RXH2 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33
GABRG1 Q8N1C3 1/20 0.33
GABRG3 Q99928 1/20 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
SCHEMBL51954 0.83 GABRP (0.44) ALDH1A1KDM4EKDM4CGABRPGABRD
SCHEMBL30119823 0.83 GABRP (0.44) ALDH1A1KDM4EKDM4CGABRPGABRD
SCHEMBL52126 0.82 TSHR (0.46) ALDH1A1KDM4EMAOBMEN1CYP1A2
SCHEMBL29447786 0.82 TSHR (0.46) ALDH1A1KDM4EMAOBMEN1CYP1A2
SCHEMBL29052637 0.78 GABRP (0.40) ALDH1A1USP2KDM4EKDM4CGABRP
SCHEMBL10940641 0.77 MAOA (0.42) ALDH1A1KDM4EGABRPGABRDGABRA1
SCHEMBL9681229 0.77 MAPT (0.46) PKMALDH1A1KDM4EGABRPGABRD
SCHEMBL10936288 0.76 MAOA (0.38) ALDH1A1KDM4EGABRPGABRDGABRA1
SCHEMBL29162696 0.75 TSHR (0.46) ALDH1A1KDM4EMAOAMAOBMEN1
SCHEMBL31314644 0.74 TSHR (0.43) ALDH1A1KDM4EMEN1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897860-A Method for manufacturing separator for lithium secondary battery having crosslinked structure, separator for lithium secondary battery having crosslinked structure obtained thereby, and lithium secondary battery comprising same 株式会社LG化学 2024-04-16 CN disclosed