SCHEMBL17022994

SCHEMBL17022994

CCCC[N+](C)(CCCC)CC(C)(C)N(Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.33
SLC22A1 O15245 1/20 0.33
HTT P42858 1/20 0.30

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
Hydrochloric Acid SCHEMBL3250333 0.98 PLA2G1B (0.32) DNM1SLC22A1
SCHEMBL12852567 0.82 DNM1 (0.32) DNM1SLC22A1
SCHEMBL17022996 0.81 SLC22A1 (0.46) DNM1SLC22A1
Hydrochloric Acid SCHEMBL3246735 0.80 PLA2G1B (0.31) DNM1SLC22A1
Hydrochloric Acid SCHEMBL3252518 0.79 SLC22A1 (0.44) DNM1SLC22A1
SCHEMBL12852740 0.73 DNM1 (0.46) DNM1SLC22A1HTT
Hydrochloric Acid SCHEMBL3249351 0.72 DNM1 (0.45) DNM1SLC22A1HTT
SCHEMBL17023000 0.71 DNM1 (0.33) DNM1SLC22A1HTT
SCHEMBL17023004 0.71 SLC22A1 (0.50) DNM1SLC22A1
Hydrochloric Acid SCHEMBL3247238 0.69 PLA2G1B (0.32) DNM1SLC22A1

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
EP-2341886-B1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS INC (US) 2015-08-26 EP claimed