SCHEMBL20175886

SCHEMBL20175886

CCCC[N+](CC)(CCC)CCO

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 4/20 0.50
DNM1 Q05193 5/20 0.48
SLC22A2 O15244 1/20 0.43

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
SCHEMBL28463870 0.95 SLC22A1 (0.55) SLC22A1DNM1SLC22A2
SCHEMBL28464784 0.95 SLC22A1 (0.55) SLC22A1DNM1SLC22A2
SCHEMBL28470023 0.90 SLC22A1 (0.63) SLC22A1DNM1SLC22A2
SCHEMBL28463851 0.90 SLC22A1 (0.63) SLC22A1DNM1SLC22A2
SCHEMBL28463853 0.90 SLC22A1 (0.55) SLC22A1DNM1SLC22A2
SCHEMBL20175892 0.90 SLC22A1 (0.50) SLC22A1DNM1
SCHEMBL28465660 0.90 SLC22A1 (0.50) SLC22A1DNM1
Bromide SCHEMBL11755830 0.88 DNM1 (0.54) SLC22A1DNM1SLC22A2
SCHEMBL10002128 0.88 DNM1 (0.50) SLC22A1DNM1SLC22A2
SCHEMBL5354508 0.87 SLC22A1 (0.65) SLC22A1DNM1SLC22A2

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
US-20180143532-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-24 US disclosed