SCHEMBL3709809

SCHEMBL3709809

Cn1[c]cc2cc(Oc3ccc(N)cn3)ccc21

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
POLB P06746 2/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 1/20 0.49
BRCA1 P38398 1/20 0.49
HBB P68871 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KEAP1 Q14145 1/20 0.37
THRB P10828 1/20 0.37
SCN9A Q15858 12/20 0.35
SCN7A Q01118 3/20 0.35
KCNH2 Q12809 3/20 0.35
SCN5A Q14524 3/20 0.35
SCN10A Q9Y5Y9 2/20 0.35
SCN2A Q99250 1/20 0.33
SCN8A Q9UQD0 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
SCHEMBL6209850 0.79 KDM4E (0.52) KDM4EPOLBRAB9AMEN1KMT2A
SCHEMBL10181440 0.76 THRB (0.45) THRBSCN9ASCN7AKCNH2SCN5A
SCHEMBL7835979 0.74 PRKCI (0.50) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL539086 0.71 ALDH1A1 (0.45) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL20931746 0.70 KDM4E (0.79) KDM4EPOLBRAB9AMEN1KMT2A
SCHEMBL3702189 0.70 HSPB1 (0.52) RAB9AMEN1KMT2AALDH1A1
SCHEMBL5342115 0.70 KDM4E (0.62) KDM4EPOLBRAB9AMEN1KMT2A
SCHEMBL3708088 0.69 KDM4E (0.50) KDM4EPOLBRAB9AMEN1KMT2A
SCHEMBL6210172 0.68 KDM4E (0.59) KDM4EPOLBMEN1KMT2A
SCHEMBL8736385 0.68 KDM4E (0.69) KDM4EPOLBRAB9AMEN1KMT2A

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
EP-2207773-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF Otsuka Pharmaceutical Co., Ltd. (JP) 2010-07-21 EP disclosed
WO-2009057811-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-05-07 WO disclosed