SCHEMBL31570146

SCHEMBL31570146

CC(=O)N1CC(c2ccc3nnc(O)cc3c2)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ QDPR P09417 2/20 0.42
▸ PDE4B Q07343 2/20 0.36
▸ FASN P49327 1/20 0.34
▸ BRD4 O60885 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ TLR8 Q9NR97 2/20 0.33
▸ TLR7 Q9NYK1 2/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM3A Q9Y4C1 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ DYRK1A Q13627 2/20 0.32
▸ PROKR1 Q8TCW9 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE4C Q08493 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
SCHEMBL26685025 1.00 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL26685131 0.89 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL31570183 0.89 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL26685015 0.82 SMARCA2 (0.47) QDPRBRD4SMARCA2SMARCA4PBRM1
SCHEMBL31570175 0.82 SMARCA2 (0.47) QDPRBRD4SMARCA2SMARCA4PBRM1
SCHEMBL26685079 0.76 DPP4 (0.39) BRD4KDM4EKDM4AKDM5CKDM4C
SCHEMBL26888672 0.76 QDPR (0.59) QDPRPDE4BBRD4TLR8TLR7
SCHEMBL26685251 0.76 DRD2 (0.38) QDPRPDE4BMAP3K12
SCHEMBL30632548 0.74 QDPR (0.38) QDPR
SCHEMBL31570168 0.72 SMARCA2 (0.47) QDPRBRD4SMARCA2SMARCA4PBRM1

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
CN-119998278-A Compounds and uses thereof 福宏治疗公司 2025-05-13 — — CN disclosed
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