SCHEMBL7795905

SCHEMBL7795905

CCOc1cc(OC)c2c(c1N)C(=O)c1cccc(OC(C)C3CCCN3)c1-2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.36
P2RY2 P41231 3/20 0.35
PDE4A P27815 3/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
PDE4D Q08499 3/20 0.35
PDCD1LG2 Q9BQ51 2/20 0.34
CD274 Q9NZQ7 2/20 0.34
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
PTPRC P08575 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
P2RY4 P51582 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
SCHEMBL7796488 0.96 TTR (0.36) TTRP2RY2PDE4APDE4BPDE4C
SCHEMBL7792460 0.95 TTR (0.37) TTRP2RY2PDE4APDE4BPDE4C
SCHEMBL7795886 0.94 TTR (0.37) TTRP2RY2PDE4APDE4BPDE4C
SCHEMBL7795920 0.93 CHRNB4 (0.34) P2RY2PDE4APDCD1LG2CD274CHRNB4
SCHEMBL7792699 0.93 PDCD1LG2 (0.35) P2RY2PDCD1LG2CD274SLC6A2SLC6A4
SCHEMBL7795780 0.93 PDCD1LG2 (0.35) P2RY2PDCD1LG2CD274SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7792171 0.92 CHRNB4 (0.34) P2RY2PDCD1LG2CD274CHRNB4CHRNA3
SCHEMBL7796413 0.91 TTR (0.35) TTRP2RY2PDCD1LG2CD274PTPRC
SCHEMBL7792221 0.91 TTR (0.35) TTRP2RY2PDCD1LG2CD274PTPRC
SCHEMBL7796125 0.91 TTR (0.37) TTRP2RY2PTPRCSLC6A2SLC6A4

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
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed