Sugi Predict

Sugi Predict / Compounds / SCHEMBL23901023

SCHEMBL23901023

SCHEMBL23901023

CCCCCCOC(=O)NC1CCC(N)CC1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ EPHX1 P07099 2/20 0.51
▸ NAAA Q02083 2/20 0.51
▸ SMYD3 Q9H7B4 1/20 0.49
▸ ACHE P22303 6/20 0.46
▸ TLR2 O60603 2/20 0.45

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
SCHEMBL87421 0.94 GAA (0.52) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL84042 0.94 GAA (0.52) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16544772 0.92 GAA (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL10793711 0.92 GAA (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16526220 0.91 GAA (0.66) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL4719490 0.85 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL13387564 0.85 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL10995376 0.85 GAA (0.60) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL1690687 0.84 EPHX1 (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL28059725 0.84 EPHX1 (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1

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-20210309882-A1 COATING COMPOSITIONS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-10-07 — — US disclosed