SCHEMBL4883083

SCHEMBL4883083

CCN(Cc1ccccc1)Cc1ccc(C(C)=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
HRH3 Q9Y5N1 1/20 0.60
ACHE P22303 4/20 0.58
BCHE P06276 3/20 0.58
L3MBTL1 Q9Y468 1/20 0.57
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
MAOB P27338 1/20 0.50
CNR2 P34972 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL540981 0.89 HRH3 (0.71) LMNAHRH3ACHEBCHEL3MBTL1
SCHEMBL16706846 0.86 LMNA (0.62) LMNAHRH3MAOBALDH1A1KMT2A
SCHEMBL14538249 0.85 PLA2G10 (0.61) LMNAACHEBCHEL3MBTL1HDAC8
SCHEMBL12763727 0.83 CNR2 (0.67) HRH3ACHEBCHEL3MBTL1MAOB
SCHEMBL375111 0.81 KDM4E (0.68) LMNAHRH3BCHEL3MBTL1MAOB
SCHEMBL16187980 0.81 ACHE (0.63) HRH3ACHEBCHEL3MBTL1HDAC8
SCHEMBL4885900 0.81 HDAC8 (0.50) ACHEBCHEL3MBTL1HDAC8HDAC6
Hydrochloric Acid SCHEMBL11608574 0.79 KDM4E (0.66) HRH3BCHEL3MBTL1MAOBCNR2
Benzoic Acid SCHEMBL4162737 0.79 MEP1B (0.55) LMNAACHEBCHEL3MBTL1HDAC8
SCHEMBL4289838 0.78 HDAC8 (0.66) HRH3ACHEBCHEHDAC8HDAC6

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194681-A1 Novel Inhibitors of Histone Deacetylase for the Treatment of Disease KALYPSYS, INC. (US) 2008-08-14 US disclosed
US-20080194681-A1 Novel Inhibitors of Histone Deacetylase for the Treatment of Disease KALYPSYS, INC. (US) 2008-08-14 US disclosed
US-20080194681-A1 Novel Inhibitors of Histone Deacetylase for the Treatment of Disease KALYPSYS, INC. (US) 2008-08-14 US disclosed
EP-1819669-A2 NOVEL INHIBITORS OF HISTONE DEACETYLASE FOR THE TREATMENT OF DISEASE Kalypsys, Inc. (US) 2007-08-22 EP disclosed
WO-2006063294-A2 NOVEL INHIBITORS OF HISTONE DEACETYLASE FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2006-06-15 WO disclosed
WO-2006063294-A2 NOVEL INHIBITORS OF HISTONE DEACETYLASE FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2006-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080194681-A1 Novel Inhibitors of Histone Deacetylase for the Treatment of Disease HDAC1, HDAC10, HDAC6 LMNA 1567/4885HRH3 33/4885ACHE 3224/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.