SCHEMBL25822713

SCHEMBL25822713

CCOC(C)(C#CCN(CC)CC)CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPY2R P49146 1/20 0.30
GAA P10253 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
SCHEMBL13430797 0.80 MMP8 (0.32)
SCHEMBL25819543 0.77 CHRM2 (0.37) MEN1KMT2AKDM4EALDH1A1CHRM2
SCHEMBL21192215 0.75 CHRM2 (0.40) MEN1KMT2AKDM4EALDH1A1CHRM2
SCHEMBL14400169 0.73
SCHEMBL9300398 0.69 MMP8 (0.31)
SCHEMBL25747740 0.68 KCNH2 (0.36) KDM4EALDH1A1CHRM2CHRM4CHRM5
SCHEMBL2611009 0.67 MEN1 (0.42) MEN1KMT2AKDM4EALDH1A1CHRM2
SCHEMBL22621651 0.65 MEN1 (0.42) MEN1KMT2AKDM4EALDH1A1CHRM2
SCHEMBL21192211 0.64 CHRM2 (0.43) MEN1KMT2AKDM4EALDH1A1CHRM2
SCHEMBL8992314 0.64 MEN1 (0.40) MEN1KMT2AKDM4EALDH1A1CHRM2

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-2023126259-A1 ALKALINE COMPOSITION FOR COPPER ELECTROPLATING COMPRISING A DEFECT REDUCTION AGENT BASF SE (DE) 2023-07-06 WO disclosed