SCHEMBL7792243

SCHEMBL7792243

CC(C)Oc1cccc(C2=NC(C)(C)CO2)c1OC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
HRH3 Q9Y5N1 2/20 0.36
ATM Q13315 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.34
IL2 P60568 1/20 0.33
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
HTR5A P47898 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
MEN1 O00255 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
SCHEMBL6299778 0.79 KDM4E (0.50) KDM4EALDH1A1TP53SMN1; SMN2NPSR1
SCHEMBL7794735 0.76 KDM4E (0.37) KDM4ECA1CA2CA7CA9
SCHEMBL9737071 0.76 KDM4E (0.43) KDM4EHRH3ATMALDH1A1HTT
SCHEMBL7105642 0.76 KDM4E (0.47) KDM4ECA1CA2HRH3ATM
SCHEMBL18380643 0.74 KDM4E (0.61) KDM4EHRH3ATMALDH1A1HTT
SCHEMBL29616919 0.74 KDM4E (0.61) KDM4EHRH3ATMALDH1A1HTT
SCHEMBL540 0.74 KDM4E (0.50) KDM4EATMALDH1A1HTTTP53
SCHEMBL9702416 0.73 KDM4E (0.50) KDM4EHRH3ATMALDH1A1HTT
SCHEMBL10737493 0.71 KDM4E (0.47) KDM4EATMALDH1A1HTTTP53
SCHEMBL14352379 0.71 KDM4E (0.59) KDM4EHRH3ATMALDH1A1HTT

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