SCHEMBL28484611

SCHEMBL28484611

Nc1cnn(C2CCOOC2)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.34
▸ KIT P10721 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ LRRK2 Q5S007 4/20 0.31
▸ MPO P05164 1/20 0.30
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PI4KA P42356 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ PI4KB Q9UBF8 1/20 0.30
▸ MET P08581 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
SCHEMBL1703399 0.85 LRRK2 (0.40) KDM5AKITJAK2LRRK2MPO
SCHEMBL1703270 0.85 LRRK2 (0.40) KDM5AKITJAK2LRRK2MPO
SCHEMBL12598741 0.85 LRRK2 (0.40) KDM5AKITJAK2LRRK2MPO
SCHEMBL1422774 0.81 MET (0.41) KDM5AJAK2LRRK2MPOMET
SCHEMBL15652587 0.79 BMPR1A (0.37) KDM5AKITJAK2LRRK2MPO
SCHEMBL173506 0.78 — —
SCHEMBL2574462 0.77 KIT (0.48) KDM5AKITJAK2LRRK2MPO
Hydrochloric Acid SCHEMBL25243994 0.76 PIK3CD (0.41) KDM5AMPOPIK3CDPIK3CAPIK3CB
Hydrochloric Acid SCHEMBL31507950 0.76 PIK3CD (0.41) KDM5AMPOPIK3CDPIK3CAPIK3CB
SCHEMBL10282490 0.73 ACHE (0.46) KDM5AJAK2MPOPIK3CDPIK3CA

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
CN-111825656-B Inhibitors of protein arginine methyltransferase 5 (PRMT 5), pharmaceutical products thereof, and methods thereof 南京药石科技股份有限公司 2023-03-31 — — CN disclosed
CN-111825656-A Inhibitors of protein arginine methyltransferase 5(PRMT5), pharmaceutical products thereof, and methods thereof 南京药石科技股份有限公司 2020-10-27 — — CN disclosed
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