SCHEMBL7795872

SCHEMBL7795872

CCOc1cc(OC)cc2c1-c1c(OC(C)C3CCCCN3)cccc1C2=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.42
SLC6A3 Q01959 5/20 0.42
SLC6A4 P31645 4/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TTR P02766 1/20 0.37
PTPRC P08575 1/20 0.36
MAOA P21397 1/20 0.36
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL7795942 0.97 SLC6A2 (0.38) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7794729 0.94 TTR (0.38) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7795927 0.94 TTR (0.38) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7795933 0.93 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7792329 0.93 SLC6A2 (0.40) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7791964 0.92 TTR (0.39) SLC6A2SLC6A3SLC6A4TTRPTPRC
SCHEMBL7791850 0.92 TTR (0.39) SLC6A2SLC6A3SLC6A4TTRPTPRC
SCHEMBL7795698 0.91 ALDH1A1 (0.43) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7792133 0.91 TTR (0.36) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL7795746 0.90 SLC6A2 (0.37) SLC6A2SLC6A3SLC6A4MEN1KMT2A

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