SCHEMBL31612848

SCHEMBL31612848

CCCCCCc1cc([Sn](C)(C)C)sc1-c1ccc(N(c2ccccc2)c2ccc(-c3sc([Sn](C)(C)C)cc3CCCCCC)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.35
▸ TLR8 Q9NR97 1/20 0.34
▸ CYSLTR2 Q9NS75 3/20 0.33
▸ CYSLTR1 Q9Y271 3/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ GPR35 Q9HC97 1/20 0.33
▸ ALOX5 P09917 3/20 0.32
▸ PTGES O14684 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TYR P14679 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32

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
SCHEMBL31030239 0.81 APP (0.45) LIPGTLR8CYSLTR2CYSLTR1BID
SCHEMBL31030240 0.81 APP (0.45) LIPGTLR8CYSLTR2CYSLTR1BID
SCHEMBL16039801 0.79 GPR35 (0.40) LIPGGPR35ALOX5MEN1TP53
SCHEMBL15572259 0.79 GPR35 (0.40) LIPGGPR35ALOX5MEN1TP53
SCHEMBL3780382 0.78 LIPG (0.38) LIPGTLR8CYSLTR2CYSLTR1ALOX5
SCHEMBL26066513 0.78 APP (0.41) LIPGTLR8CYSLTR2CYSLTR1KCNH2
SCHEMBL14948637 0.76 LIPG (0.39) LIPGTLR8CYSLTR2CYSLTR1KCNH2
SCHEMBL14253108 0.74 LTB4R (0.39) LIPGTLR8CYSLTR2CYSLTR1KCNH2
SCHEMBL1279225 0.74 ALOX5 (0.37) LIPGKCNH2GPR35ALOX5MEN1
SCHEMBL14941717 0.74 CYSLTR2 (0.31) CYSLTR2CYSLTR1

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-120118101-A Organic compound capable of generating Raman spectrum signal and photo-thermal effect, nano preparation and preparation method 上海交通大学医学院 2025-06-10 — — CN disclosed
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