SCHEMBL5288484

SCHEMBL5288484

CCCc1cc[n+](Cc2ccccc2)cc1CCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 7/20 0.46
▸ LMNA P02545 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ACHE P22303 3/20 0.43
▸ BCHE P06276 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TP53 P04637 1/20 0.39

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
SCHEMBL5295886 0.90 CHKA (0.44) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5298333 0.89 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5287311 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5294482 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5299981 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5296834 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5284857 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5298914 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5292346 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2
SCHEMBL5289423 0.87 HTT (0.42) CHKALMNAALDH1A1HTTSMN1; SMN2

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-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 — — WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 — — WO disclosed
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