SCHEMBL31570183

SCHEMBL31570183

CC(=O)N1CC(c2ccc3cc(O)nnc3c2)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
▸ KDM4A O75164 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM3A Q9Y4C1 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ PROKR1 Q8TCW9 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ MAP3K12 Q12852 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ EGFR P00533 2/20 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
SCHEMBL26685131 1.00 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL31570146 0.89 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL26685025 0.89 QDPR (0.42) QDPRPDE4BFASNBRD4KDM4E
SCHEMBL26888672 0.87 QDPR (0.59) QDPRPDE4BBRD4PDE10AEGFR
SCHEMBL30632548 0.84 QDPR (0.38) QDPRPDE10ASCD5
SCHEMBL26685057 0.82 SMARCA2 (0.47) QDPRBRD4
SCHEMBL31570168 0.82 SMARCA2 (0.47) QDPRBRD4
SCHEMBL26685079 0.76 DPP4 (0.39) BRD4KDM4EKDM4AKDM5CKDM4C
SCHEMBL26685482 0.76 DRD2 (0.38) QDPRPDE4BMAP3K12SCD5
SCHEMBL31570175 0.72 SMARCA2 (0.47) QDPRBRD4

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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