SCHEMBL7786129

SCHEMBL7786129

CCCOc1cc(OCCC)c2c(c1)C(=O)c1cccc(OC(C)C3CCCCN3)c1-2

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A2 P23975 5/20 0.36
SLC6A3 Q01959 5/20 0.36
SLC6A4 P31645 4/20 0.36
ELANE P08246 2/20 0.35

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
SCHEMBL7792340 0.97 KCNA3 (0.37) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7794865 0.96 HTR2A (0.35) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7792133 0.96 TTR (0.36) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7795846 0.96 HTR2A (0.36) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7795933 0.95 SLC6A2 (0.41) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7786280 0.95 SLC6A2 (0.39) HTR2AHTR2CHTR2BSLC6A2SLC6A3
SCHEMBL7786155 0.94 TTR (0.36) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7792664 0.94 HTR2A (0.36) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7792026 0.94 HTR2A (0.37) KCNA3HTR2AHTR2CHTR2BSLC6A2
SCHEMBL7786428 0.92 CHRNB4 (0.36) KCNA3HTR2AHTR2CHTR2BSLC6A2

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 4 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
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed