SCHEMBL28844151

SCHEMBL28844151

CCCCOc1ncnc(N(N)C(=O)NN)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PKM P14618 1/20 0.36
MAPK8 P45983 3/20 0.36
ACACB O00763 1/20 0.34
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
XDH P47989 1/20 0.32
HTT P42858 2/20 0.31
MAPK9 P45984 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL28167498 0.83 KDM4E (0.33) LMNAXDH
SCHEMBL27884312 0.79 KDM4E (0.33) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL28122016 0.78 MEN1 (0.33) MEN1KMT2AACACB
SCHEMBL28176542 0.78 MAPK8 (0.39) MAPK8
SCHEMBL27489014 0.77 MAPT (0.40) ACACBMAPTALDH1A1
SCHEMBL28091717 0.74 KDM4E (0.32) SMN1; SMN2ALDH1A1
SCHEMBL11811968 0.74 SMN1; SMN2 (0.43) LMNASMN1; SMN2PKMHTTALDH1A1
SCHEMBL28784750 0.72
SCHEMBL27461054 0.72 HTT (0.42) MEN1KMT2ALMNASMN1; SMN2MAPK8
SCHEMBL27634141 0.71 THRB (0.34) HTT

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
CN-104185654-B Weather resistant polyoxymethylene compositions 塞拉尼斯销售德国有限公司 2017-04-19 CN disclosed