SCHEMBL5288629

SCHEMBL5288629

CCCCCCCCCCCc1cccc[n+]1C

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 8/20 0.63
HSD17B10 Q99714 1/20 0.44
LIPG Q9Y5X9 1/20 0.42

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
SCHEMBL2563319 1.00 KCNH2 (0.63) KCNH2HSD17B10LIPG
SCHEMBL27633428 1.00 KCNH2 (0.63) KCNH2HSD17B10LIPG
SCHEMBL28905757 1.00 KCNH2 (0.63) KCNH2HSD17B10LIPG
Hydrochloric Acid SCHEMBL3028802 0.98 KCNH2 (0.61) KCNH2HSD17B10LIPG
Hydrochloric Acid SCHEMBL27658816 0.98 KCNH2 (0.61) KCNH2HSD17B10LIPG
Hydrochloric Acid SCHEMBL8508951 0.98 KCNH2 (0.61) KCNH2HSD17B10LIPG
Hydrochloric Acid SCHEMBL27658826 0.98 KCNH2 (0.61) KCNH2HSD17B10LIPG
Bromide SCHEMBL27658806 0.98 KCNH2 (0.61) KCNH2HSD17B10LIPG
Iodide SCHEMBL28049744 0.96 KCNH2 (0.59) KCNH2HSD17B10LIPG
Iodide SCHEMBL28049741 0.95 KCNH2 (0.58) KCNH2HSD17B10

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
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed