SCHEMBL22424688

SCHEMBL22424688

O=CN1CCc2c(nc(NCc3ccccc3)[nH]c2=O)C1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.67
▸ PKM P14618 1/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ CLPP Q16740 18/20 0.64

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
SCHEMBL31087175 0.80 HPGD (1.00) HPGDPKML3MBTL1CLPP
SCHEMBL22423998 0.75 CLPP (0.60) HPGDPKML3MBTL1CLPP
SCHEMBL22424056 0.67 CLPP (0.56) HPGDPKML3MBTL1CLPP
SCHEMBL3304711 0.66 PNP (0.60) HPGDPKML3MBTL1CLPP
SCHEMBL11760490 0.66 PNP (0.60) HPGDPKML3MBTL1CLPP
SCHEMBL2776453 0.65 PNP (0.62) HPGDPKML3MBTL1CLPP
SCHEMBL3053501 0.65 SLC6A5 (0.58) HPGDCLPP
SCHEMBL721339 0.65 SLC6A5 (0.58) HPGDCLPP
SCHEMBL14681363 0.64 PARP14 (0.82) HPGDPKML3MBTL1
SCHEMBL3433598 0.64 PNP (0.68) HPGDPKML3MBTL1

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-2020182990-A1 FUSED RING PYRIMIDONE DERIVATIVES FOR USE IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES Janssen Sciences Ireland Unlimited Company (IE) 2020-09-17 — — WO disclosed
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