SCHEMBL1807928

SCHEMBL1807928

FC(F)(F)c1cccc(NN2CCCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 3/20 0.54
RAB9A P51151 2/20 0.54
IDH2 P48735 2/20 0.52
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 4/20 0.47
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
POLB P06746 3/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.45
XBP1 P17861 1/20 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
SCHEMBL31587418 0.85 KMT2A (0.47) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL6502465 0.85 IDH2 (0.56) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL31588115 0.85 IDH2 (0.48) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL30432445 0.85 LMNA (0.60) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL27875853 0.85 MEN1 (0.46) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL31587567 0.84 MEN1 (0.45) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL31587536 0.79 L3MBTL1 (0.46) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL3544482 0.79 POLB (0.44) MEN1KMT2ARAB9AALDH1A1POLB
SCHEMBL31587954 0.78 IDH2 (0.43) MEN1KMT2AL3MBTL1RAB9AIDH2
SCHEMBL5536753 0.77 KDM4E (0.49) MEN1KMT2AL3MBTL1ALDH1A1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011061277-A1 AMINO ARYL ACETAMIDES AND THEIR USE IN THE TREATMENT OF MALARIA GLAXO GROUP LIMITED (GB) 2011-05-26 WO disclosed
WO-2008089034-A2 CYTOKINE INHIBITORS KEMIA, INC. (US) 2008-07-24 WO disclosed