SCHEMBL18950347

SCHEMBL18950347

CCCCOC(=O)NC1CN(C)C1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NAAA Q02083 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
EPHX1 P07099 2/20 0.43
ACHE P22303 7/20 0.42
ALDH1A1 P00352 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
SCHEMBL6921872 0.84 SMN1; SMN2 (0.55) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL13387564 0.82 GAA (0.59) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL4719490 0.82 GAA (0.59) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL4473083 0.81 GAA (0.46) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL26677284 0.79 EPHX1 (0.59) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL1827279 0.79 EPHX1 (0.64) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16377759 0.79 SMN1; SMN2 (0.50) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL2801497 0.78 EPHX1 (0.67) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL22801974 0.78 GAA (0.51) GAAMAPK1HTTSMN1; SMN2NAAA
SCHEMBL3332407 0.78 NAAA (0.52) GAAMAPK1HTTSMN1; SMN2NAAA

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-9676783-B2 Method of treatment using substituted pyrazolo[1,5-A] pyrimidine compounds ARRAY BIOPHARMA, INC. (US) 2017-06-13 US disclosed