SCHEMBL7795878

SCHEMBL7795878

CCCOc1ccc(OCCCN(CC)CC)c2c1-c1c(OCCCN(CC)CC)cccc1C2=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.45
ALDH1A1 P00352 2/20 0.44
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TERT O14746 1/20 0.41
FLT3 P36888 3/20 0.41
MAOB P27338 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL7796356 0.95 HTR1B (0.45) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7791858 0.94 MAOB (0.46) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7792085 0.93 KCNA3 (0.48) KCNA3ALDH1A1HTR1DHTR1BTERT
SCHEMBL7794690 0.92 KCNA3 (0.45) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7794780 0.91 ALDH1A1 (0.52) KCNA3ALDH1A1KDM4ETDP1TERT
SCHEMBL7796426 0.90 HTR1B (0.48) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7795729 0.88 ELANE (0.50) KCNA3ALDH1A1HTR1DHTR1BTERT
SCHEMBL7791883 0.87 CYP1A2 (0.41) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7795946 0.87 CYP1A2 (0.41) KCNA3ALDH1A1HTR1DHTR1BKDM4E
SCHEMBL7792639 0.87 MAPT (0.50) KCNA3ALDH1A1HTR1DHTR1BKDM4E

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