SCHEMBL28438091

SCHEMBL28438091

CN1CCC[C@@H](Nc2nc3cc[nH]c3c(=O)n2C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 20/20 1.00
▸ SETDB1 Q15047 2/20 0.63
▸ BPTF Q12830 1/20 0.55
▸ KAT2A Q92830 1/20 0.55

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
SCHEMBL28438090 1.00 KAT2B (1.00) KAT2BSETDB1BPTFKAT2A
SCHEMBL29413001 0.78 KAT2B (1.00) KAT2BSETDB1BPTFKAT2A
SCHEMBL31091734 0.74 KAT2B (0.81) KAT2BSETDB1BPTFKAT2A
SCHEMBL29412997 0.72 KAT2B (1.00) KAT2BSETDB1BPTFKAT2A
SCHEMBL31091717 0.70 KAT2B (0.73) KAT2BSETDB1BPTFKAT2A
SCHEMBL29413023 0.67 KAT2B (0.49) KAT2BSETDB1
SCHEMBL17571635 0.67 KAT2B (1.00) KAT2BBPTF
SCHEMBL30374596 0.67 KAT2B (0.50) KAT2BBPTF
SCHEMBL26093063 0.67 KAT2B (0.50) KAT2BBPTF
SCHEMBL26093572 0.67 KAT2B (0.50) KAT2BBPTF

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-111499639-B Pyrimidone derivatives and their use in pharmacy 四川大学华西医院 2022-03-04 — — CN disclosed
CN-111499639-A Pyrimidone derivatives and their use in pharmacy 四川大学华西医院 2020-08-07 — — CN disclosed
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