SCHEMBL7794865

SCHEMBL7794865

CCCOc1cc(OCC)cc2c1-c1c(OC(C)C3CCCCN3)cccc1C2=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
SLC6A2 P23975 5/20 0.35
SLC6A3 Q01959 5/20 0.35
SLC6A4 P31645 4/20 0.35
TTR P02766 1/20 0.34
PTPRC P08575 1/20 0.33
KCNA3 P22001 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL7792664 0.97 HTR2A (0.36) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7792133 0.96 TTR (0.36) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7786129 0.96 KCNA3 (0.36) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7795846 0.95 HTR2A (0.36) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7794729 0.94 TTR (0.38) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7786155 0.94 TTR (0.36) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7792340 0.94 KCNA3 (0.37) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7795933 0.93 SLC6A2 (0.41) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7792026 0.92 HTR2A (0.37) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7791964 0.92 TTR (0.39) HTR2AHTR2CHTR2BSLC6A2SLC6A3

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