SCHEMBL4574504

SCHEMBL4574504

Fc1ccc(C2(c3noc(CCl)n3)CCOCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
RBP1 P09455 3/20 0.36
HTT P42858 1/20 0.35
ALOX5AP P20292 5/20 0.34
S1PR1 P21453 1/20 0.33
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL4574278 0.92 KMT2A (0.41) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574830 0.89 KMT2A (0.47) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4746729 0.88 KMT2A (0.40) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL8212341 0.88 KMT2A (0.46) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574604 0.79 KMT2A (0.42) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4575272 0.78 KMT2A (0.55) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL8223460 0.77 RBP1 (0.40) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574917 0.77 KMT2A (0.46) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574617 0.76 KMT2A (0.62) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4575063 0.75 ALOX5AP (0.43) KMT2AMEN1L3MBTL1LMNAMAPT

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-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed
WO-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed