SCHEMBL27429480

SCHEMBL27429480

Cc1ccc(CNc2nc(N3CCCN(C)CC3)nc3nccnc23)cc1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.47
▸ PDE4B Q07343 1/20 0.47
▸ PDE4C Q08493 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ CCNE1 P24864 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ HRH4 Q9H3N8 10/20 0.43
▸ PDE5A O76074 1/20 0.43
▸ HTR3A P46098 3/20 0.42
▸ CSNK1D P48730 2/20 0.41
▸ CSNK1E P49674 2/20 0.41
▸ TLR9 Q9NR96 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ EZH2 Q15910 1/20 0.40
▸ EHMT2 Q96KQ7 1/20 0.40
▸ HTR6 P50406 1/20 0.40
▸ ACHE P22303 1/20 0.40

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
SCHEMBL27429475 0.96 HRH4 (0.47) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27429482 0.92 HRH4 (0.49) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27429471 0.88 HRH4 (0.52) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27248325 0.82 HPGD (0.54) HRH4HTR3A
SCHEMBL27248344 0.82 HRH4 (0.64) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27429472 0.78 CSNK1E (0.45) CCNE1CDK2HRH4CSNK1DCSNK1E
SCHEMBL27429713 0.78 PTK2 (0.47) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27248311 0.78 HPGD (0.58) HRH4
SCHEMBL27429799 0.77 HRH4 (0.45) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL27429801 0.76 JAK3 (0.47) PDE4APDE4BPDE4CPDE4DHRH4

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-2024118607-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CHDI FOUNDATION, INC. (US) 2024-06-06 — — WO disclosed
Send feedback