SCHEMBL17308301

SCHEMBL17308301

CCc1ccnc(OC2CCN(C)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.52
LOXL2 Q9Y4K0 1/20 0.52
HCRTR1 O43613 1/20 0.47
HCRTR2 O43614 1/20 0.47
LRRK2 Q5S007 1/20 0.42
WNT1 P04628 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
TDO2 P48775 1/20 0.39
PIK3CD O00329 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
LNPEP Q9UIQ6 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
MET P08581 1/20 0.37
TLR9 Q9NR96 1/20 0.37
TLR8 Q9NR97 1/20 0.37
TLR7 Q9NYK1 1/20 0.37

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
SCHEMBL20890609 0.88 LOXL2 (0.60) LOXLOXL2HCRTR1HCRTR2NOS3
SCHEMBL445290 0.87 LOXL2 (0.70) LOXLOXL2HCRTR1HCRTR2LRRK2
SCHEMBL17308336 0.85 LOX (0.66) LOXLOXL2HCRTR1HCRTR2LRRK2
SCHEMBL17308310 0.83 CACNB4 (0.48) LOXLOXL2HCRTR1HCRTR2TDO2
SCHEMBL21297230 0.83 PRMT5 (0.49) LOXLOXL2HCRTR1HCRTR2LNPEP
SCHEMBL19633597 0.82 GPR119 (0.47) LOXLOXL2HCRTR1HCRTR2NOS3
SCHEMBL17072669 0.81 LOX (0.54) LOXLOXL2HCRTR1HCRTR2WNT1
SCHEMBL16220848 0.81 LOX (0.54) LOXLOXL2HCRTR1HCRTR2LRRK2
SCHEMBL21311492 0.81 LOX (0.46) LOXLOXL2LRRK2WNT1GSK3B
SCHEMBL427767 0.81 LRRK2 (0.48) LOXLOXL2HCRTR1HCRTR2LRRK2

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
US-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 LOX 3995/4885LOXL2 4297/4885HCRTR1 4127/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.