SCHEMBL25868201

SCHEMBL25868201

O=S(=O)(CC1CCC(c2ccccc2)=N1)N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ ALDH1A1 P00352 5/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MMP3 P08254 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ DAGLA Q9Y4D2 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL25868627 0.87 PKM (0.43) TSHRHPGDALDH1A1GAAKDM4E
SCHEMBL25868195 0.87 LMNA (0.38) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL25868198 0.84 LMNA (0.45) TSHRALDH1A1GAAKDM4ELMNA
SCHEMBL25868194 0.76 LMNA (0.41) TSHRHPGDALDH1A1GAAMAPT
SCHEMBL25868529 0.73 TSHR (0.35) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL25871670 0.73 TSHR (0.35) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL25868015 0.73 TSHR (0.35) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL27884019 0.66 TAAR1 (0.37) MEN1MAPK1KMT2A
SCHEMBL28825055 0.65 CHRNB4 (0.33) MAPTKDM4EMAPK1
SCHEMBL28298385 0.64 NOS1 (0.40) TSHRALDH1A1MEN1KMT2AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023134691-A1 HIGH-VOLTAGE ELECTROLYTE AND BATTERY CONTAINING ELECTROLYTE 珠海冠宇电池股份有限公司 2023-07-20 — — WO disclosed
WO-2023134461-A1 HIGH-TEMPERATURE HIGH-VOLTAGE ELECTROLYTE, AND BATTERY CONTAINING SAME 珠海冠宇电池股份有限公司 2023-07-20 — — WO disclosed
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