SCHEMBL1542572

SCHEMBL1542572

CC(=O)c1c(OCCc2ccccn2)c(OC(CC(C)c2ccc(F)cc2)c2ccc(F)cc2)c2oc(C)nc2c1C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2C P28335 1/20 0.32
HTR7 P34969 1/20 0.32
SYK P43405 1/20 0.31
HRH2 P25021 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL2179535 0.89 MEN1 (0.35) MEN1ALDH1A1POLBGAAKMT2A
SCHEMBL1542460 0.87 KCNA3 (0.30)
SCHEMBL1542536 0.84 ADORA2A (0.31) ALDH1A1HTR2C
SCHEMBL1542528 0.83 LMNA (0.41) MEN1ALDH1A1POLBKMT2A
SCHEMBL1542264 0.82 MEN1 (0.37) MEN1ALDH1A1KMT2ARAB9A
SCHEMBL2177504 0.81 MEN1 (0.34) MEN1ALDH1A1POLBGAAKMT2A
SCHEMBL2179404 0.77 MEN1 (0.35) MEN1ALDH1A1POLBGAAKMT2A
SCHEMBL1542365 0.76 P4HB (0.34) MEN1KMT2A
SCHEMBL2178824 0.75 KCNA3 (0.32)
SCHEMBL12409102 0.75 METAP2 (0.33)

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-2303850-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF Bionomics Limited (AU) 2011-04-06 EP disclosed
WO-2009149508-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2009-12-17 WO disclosed