SCHEMBL4746729

SCHEMBL4746729

ClCc1nc(C2(c3ccc(Cl)cc3)CCOCC2)no1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
RBP1 P09455 3/20 0.37
HTT P42858 2/20 0.35
ALOX5AP P20292 2/20 0.35
P2RX7 Q99572 1/20 0.33
NOTUM Q6P988 2/20 0.33
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4574604 0.92 KMT2A (0.42) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574917 0.89 KMT2A (0.46) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574504 0.88 KMT2A (0.40) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4575272 0.79 KMT2A (0.55) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574278 0.79 KMT2A (0.41) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL8223460 0.79 RBP1 (0.40) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL16629560 0.77 KMT2A (0.47) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574617 0.77 KMT2A (0.62) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574830 0.77 KMT2A (0.47) KMT2AMEN1L3MBTL1LMNAMAPT
SCHEMBL4574182 0.76 ALOX5AP (0.45) 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-2008117148-A1 SUBSTITUTED OXADIAZOLE ANALOGS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-10-02 WO disclosed
WO-2008117148-A1 SUBSTITUTED OXADIAZOLE ANALOGS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-10-02 WO disclosed