SCHEMBL5299461

SCHEMBL5299461

CCCCC[N+]1(c2ccccc2)CCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.37
NAAA Q02083 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
APOBEC3A P31941 2/20 0.33
APOBEC3G Q9HC16 2/20 0.33
HTT P42858 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
RGS12 O14924 1/20 0.33
LTA4H P09960 1/20 0.33
EPHX1 P07099 3/20 0.33
ALDH1A1 P00352 3/20 0.33
KCNH3 Q9ULD8 1/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 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
SCHEMBL5298224 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5944599 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5290907 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5294438 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5303011 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5295179 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5305522 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5944468 0.98 NPC1 (0.36) SIGMAR1NAAANPC1RAB9AAPOBEC3A
SCHEMBL5290184 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1
SCHEMBL5304182 0.98 NAAA (0.37) SIGMAR1NAAAHTTEPHX1ALDH1A1

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 3 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
US-20060186419-A1 Light-emitting device KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-24 US disclosed