SCHEMBL7795728

SCHEMBL7795728

CCN(CC)CCCOc1cccc2c1C(=O)c1cccc(OCCCN(CC)CC)c1-2

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.52
ALDH1A1 P00352 2/20 0.48
TERT O14746 1/20 0.45
FLT3 P36888 3/20 0.44
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
MAOB P27338 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TTR P02766 1/20 0.42

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
SCHEMBL8382501 0.96 KCNA3 (0.49) KCNA3ALDH1A1TERTFLT3HTR1D
SCHEMBL7786104 0.96 KCNA3 (0.55) KCNA3ALDH1A1TERTFLT3HTR1D
SCHEMBL7791786 0.93 KCNA3 (0.50) KCNA3ALDH1A1TERTHTR1DHTR1B
Hydrochloric Acid SCHEMBL11606378 0.92 KCNA3 (0.60) KCNA3ALDH1A1FLT3HTR1DHTR1B
SCHEMBL8380843 0.89 TTR (0.49) KCNA3ALDH1A1TERTHTR1DHTR1B
SCHEMBL8380922 0.88 EGFR (0.49) KCNA3ALDH1A1TERTMAOBKDM4E
SCHEMBL7792085 0.87 KCNA3 (0.48) KCNA3ALDH1A1TERTFLT3HTR1D
SCHEMBL7795729 0.87 ELANE (0.50) KCNA3ALDH1A1TERTFLT3HTR1D
SCHEMBL7796352 0.87 KCNA3 (0.48) KCNA3ALDH1A1TERTFLT3HTR1D
SCHEMBL7794690 0.87 KCNA3 (0.45) KCNA3ALDH1A1TERTFLT3HTR1D

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