SCHEMBL25787464

SCHEMBL25787464

C=CC(=O)N1CCN(N)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET3 O43151 6/20 0.41
KMT2A Q03164 6/20 0.41
FBXL19 Q6PCT2 6/20 0.41
CXXC5 Q7LFL8 6/20 0.41
KDM2B Q8NHM5 6/20 0.41
CXXC4 Q9H2H0 6/20 0.41
KDM2A Q9Y2K7 6/20 0.41
TET1 Q8NFU7 4/20 0.41
GNAI3 P08754 1/20 0.37
GNAI1 P63096 1/20 0.37
MAPK1 P28482 1/20 0.35
TEAD1 P28347 3/20 0.35
TEAD3 Q99594 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
FGFR4 P22455 1/20 0.35
JAK3 P52333 2/20 0.33
ACHE P22303 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33

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
SCHEMBL24448615 0.89 ALDH1A1 (0.39) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL167151 0.87 TET3 (0.47) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL20547259 0.87 TET3 (0.47) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL12764449 0.87 TET3 (0.47) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL237862 0.87
Acrylamide SCHEMBL8498177 0.82 ALDH1A1 (0.58) TET3KMT2AFBXL19CXXC5KDM2B
Acrylamide SCHEMBL3714624 0.82 ALDH1A1 (0.58) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL17150702 0.80 ALDH1A1 (0.41) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL505654 0.79 ALDH1A1 (0.48) TET3KMT2AFBXL19CXXC5KDM2B
SCHEMBL149678 0.79

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-3805214-B1 JAK3 SELECTIVE INHIBITOR UNIV PEKING SHENZHEN GRADUATE SCHOOL (CN) 2023-07-05 EP disclosed