SCHEMBL318960

SCHEMBL318960

CC1=C(O[Si](C)(C)C)CC(c2ccncc2[N+](=O)[O-])OC1C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTT P42858 4/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 3/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 3/20 0.32
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
SCHEMBL14902690 1.00 MEN1 (0.34) MEN1KMT2AHTTGAAMAPT
SCHEMBL14902667 0.87 MEN1 (0.33) MEN1KMT2AHTTGAAMAPT
SCHEMBL319637 0.79 MEN1 (0.31) MEN1KMT2AHTTGAA
SCHEMBL320660 0.78 MEN1 (0.36) MEN1KMT2AHTTGAAMAPT
SCHEMBL318476 0.77 MEN1 (0.32) MEN1KMT2A
SCHEMBL1911173 0.75 MEN1 (0.38) MEN1KMT2AHTTGAAMAPT
SCHEMBL319080 0.75 MEN1 (0.38) MEN1KMT2AHTTGAAMAPT
SCHEMBL14902773 0.75 HASPIN (0.34) HTTMAPT
SCHEMBL319231 0.74 FFAR1 (0.32)
SCHEMBL319230 0.74 FFAR1 (0.32)

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-2590968-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS Novartis AG (CH) 2013-05-15 EP disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO disclosed