SCHEMBL31030239

SCHEMBL31030239

CCCCCCCCCCCCc1cc(C=O)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.45
▸ CYSLTR2 Q9NS75 5/20 0.34
▸ CYSLTR1 Q9Y271 5/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.34
▸ PTPN1 P18031 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ THRA P10827 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ BID P55957 3/20 0.33
▸ MCL1 Q07820 3/20 0.33
▸ BCL2L1 Q07817 2/20 0.33
▸ BAK1 Q16611 2/20 0.33
▸ KAT8 Q9H7Z6 2/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 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
SCHEMBL31030240 1.00 APP (0.45) APPCYSLTR2CYSLTR1NR1H2NR1H3
SCHEMBL12180551 0.87 APP (0.52) APPCYSLTR2CYSLTR1BIDMCL1
SCHEMBL15859165 0.86 INSR (0.35) TLR8
SCHEMBL13931317 0.82 NR1H2 (0.33) APPNR1H2NR1H3
SCHEMBL31612848 0.81 LIPG (0.35) CYSLTR2CYSLTR1LIPGBIDMCL1
SCHEMBL13931323 0.79 APP (0.31) APPNR1H2NR1H3
SCHEMBL3935997 0.78 ALDH1A1 (0.38) APP
SCHEMBL26066513 0.76 APP (0.41) APPCYSLTR2CYSLTR1LIPGBID
SCHEMBL14948638 0.76 APP (0.33) APP
SCHEMBL14948642 0.75 APP (0.32) APP

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-118555844-A Solid additive doped active layer and solar cell comprising same 杭州师范大学 2024-08-27 — — CN disclosed
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