SCHEMBL8225709

SCHEMBL8225709

Bc1ccc(CNC(=O)N2CCCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
MLLT1 Q03111 1/20 0.51
HRH3 Q9Y5N1 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TPSAB1 Q15661 4/20 0.49
EPHX2 P34913 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TPSD1 Q9BZJ3 3/20 0.48
TPSG1 Q9NRR2 3/20 0.48
PPID Q08752 1/20 0.48
PRSS1 P07477 2/20 0.47
F2 P00734 1/20 0.47
NOS3 P29474 1/20 0.46
NOS1 P29475 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
NAMPT P43490 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL23252438 0.83 KMT2A (0.55) MEN1KMT2AMLLT1HRH3KDM4E
SCHEMBL3126965 0.83 NPC1 (0.57) MEN1KMT2AMLLT1HRH3KDM4E
SCHEMBL4197501 0.83 KDM4E (0.69) MEN1KMT2AHRH3KDM4ETPSAB1
SCHEMBL30677754 0.82 KMT2A (0.60) MEN1KMT2AHRH3ALDH1A1
SCHEMBL6559744 0.81 KDM4E (0.68) MEN1KMT2AHRH3KDM4ETPSAB1
SCHEMBL5217325 0.81 KDM4E (0.68) MEN1KMT2AHRH3KDM4ETPSAB1
SCHEMBL4559263 0.80 TP53 (0.63) MEN1KMT2ATPSAB1TPSD1TPSG1
SCHEMBL5800630 0.79 KDM4E (0.69) MEN1KMT2AHRH3KDM4ETPSAB1
SCHEMBL5146467 0.79 TPSAB1 (0.50) MEN1KMT2AMLLT1HRH3KDM4E
SCHEMBL5740992 0.78 HRH3 (0.59) MEN1KMT2AMLLT1HRH3KDM4E

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-2007107539-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-09-27 WO disclosed