SCHEMBL5298333

SCHEMBL5298333

CCCCCc1cc[n+](Cc2ccccc2)cc1CCCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 5/20 0.42
▸ CHKA P35790 4/20 0.42
▸ LMNA P02545 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ APAF1 O14727 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ACHE P22303 2/20 0.40
▸ EEF2K O00418 2/20 0.40
▸ EEF2 P13639 2/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ JAK2 O60674 1/20 0.40

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
SCHEMBL5294482 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5299246 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5289423 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5286841 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5287311 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5296834 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5292346 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5284857 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5298914 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; SMN2
SCHEMBL5289365 0.98 HTT (0.42) HTTCHKALMNAALDH1A1SMN1; 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
Send feedback