SCHEMBL18138287

SCHEMBL18138287

CC(C)(C)OC(=O)Nc1nn(CCCO[Si](C)(C)C(C)(C)C)cc1[N+](=O)[O-]

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.34
GSTP1 P09211 1/20 0.32
GSTM2 P28161 1/20 0.32
PRMT1 Q99873 1/20 0.32
BRD4 O60885 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SCD O00767 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
NPC1 O15118 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
SCHEMBL18138350 0.94 GSTP1 (0.33) GSTP1GSTM2PRMT1BRD4L3MBTL1
SCHEMBL18131307 0.89 DUT (0.38) DUTL3MBTL1SMN1; SMN2MEN1ALDH1A1
SCHEMBL18138290 0.88 IRAK4 (0.35) GSTP1GSTM2PRMT1BRD4L3MBTL1
SCHEMBL18138300 0.85 PRMT1 (0.35) GSTP1GSTM2PRMT1BRD4L3MBTL1
SCHEMBL18138302 0.84 MMP1 (0.34) GSTP1GSTM2PRMT1BRD4ALDH1A1
SCHEMBL18138228 0.83 LMNA (0.37) GSTP1GSTM2PRMT1L3MBTL1SMN1; SMN2
SCHEMBL18138351 0.83 PRMT1 (0.36) GSTP1GSTM2PRMT1BRD4L3MBTL1
SCHEMBL18138301 0.82 ALDH1A1 (0.35) GSTP1GSTM2PRMT1BRD4L3MBTL1
SCHEMBL18131164 0.82 L3MBTL1 (0.36) DUTL3MBTL1SMN1; SMN2MEN1ALDH1A1
SCHEMBL18138283 0.80 PRMT1 (0.34) GSTP1GSTM2PRMT1L3MBTL1SMN1; SMN2

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-2016164754-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-10-13 WO disclosed