SCHEMBL7786280

SCHEMBL7786280

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
ELANE P08246 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL7786428 0.97 CHRNB4 (0.36) SLC6A2SLC6A4SLC6A3MEN1KMT2A
Hydrochloric Acid SCHEMBL7792641 0.96 CHRNB4 (0.35) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7786129 0.95 KCNA3 (0.36) SLC6A2SLC6A4SLC6A3ELANEHTR2A
SCHEMBL7795933 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7792133 0.93 TTR (0.36) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7792329 0.93 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7792340 0.92 KCNA3 (0.37) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7794865 0.91 HTR2A (0.35) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7795846 0.91 HTR2A (0.36) SLC6A2SLC6A4SLC6A3HTR2AHTR2C
SCHEMBL7786028 0.90 KMT2A (0.38) SLC6A2SLC6A4SLC6A3MEN1KMT2A

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