SCHEMBL5285547

SCHEMBL5285547

CCCCCCCCCCCc1ccc[n+](C(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 2/20 0.47
KCNH2 Q12809 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LPL P06858 3/20 0.41
LIPG Q9Y5X9 3/20 0.41
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
HTR2A P28223 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL5288522 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5290095 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5304932 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5307117 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5299451 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5287386 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5297603 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5287642 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5290442 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL
SCHEMBL5281196 1.00 GGPS1 (0.47) GGPS1KCNH2TDP1L3MBTL1LPL

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