SCHEMBL1645807

SCHEMBL1645807

COc1ccc(Cn2cc3cc(C(C)=O)ccc3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 1/20 0.45
HDAC6 Q9UBN7 5/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HDAC8 Q9BY41 4/20 0.44
HDAC11 Q96DB2 2/20 0.44
SNCA P37840 1/20 0.43
HDAC1 Q13547 3/20 0.43
HDAC2 Q92769 3/20 0.43
HDAC5 Q9UQL6 2/20 0.43
ADORA3 P0DMS8 1/20 0.43
KDM1A O60341 1/20 0.43
CACNA1G O43497 1/20 0.42
CACNA1H O95180 1/20 0.42
CACNA1I Q9P0X4 1/20 0.42
PDE1B Q01064 1/20 0.42
CYP19A1 P11511 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
SCHEMBL7977921 0.90 KDM4E (0.50) MEN1KMT2ANPC1RAB9AHDAC6
SCHEMBL760076 0.89 CA1 (0.47) MEN1KMT2ANPC1RAB9AHDAC6
SCHEMBL27750270 0.88 KMT2A (0.46) MEN1KMT2ANPC1RAB9AHDAC6
SCHEMBL7977927 0.87 HDAC6 (0.49) HDAC6L3MBTL1HDAC8HDAC11SNCA
SCHEMBL12810248 0.86 HDAC6 (0.46) MEN1KMT2AHDAC6HDAC2ALDH1A1
SCHEMBL7988907 0.85 THRB (0.50) HDAC6L3MBTL1HDAC8HDAC11SNCA
SCHEMBL6840432 0.85 ALDH1A1 (0.49) MEN1KMT2ANPC1RAB9AHDAC6
SCHEMBL9943544 0.82 IRAK4 (0.49) NPC1RAB9AHDAC6L3MBTL1SNCA
SCHEMBL662061 0.80 IDO1 (0.45) GSK3BMEN1KMT2ANPC1RAB9A
SCHEMBL12706998 0.80 CA1 (0.47) MEN1KMT2ANPC1RAB9AHDAC6

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
EP-2314295-B1 Pharmaceutical compositions for the prevention and treatment of complex diseases and their delivery by insertable medical devices RESVERLOGIX INC (CA) 2015-01-28 EP disclosed
US-8410109-B2 Pharmaceutical compositions for the prevention and treatment of complex diseases and their delivery by insertable medical devices RESVERLOGIX CORP. (CA) 2013-04-02 US disclosed
EP-2314295-A1 Pharmaceutical compositions for the prevention and treatment of complex diseases and their delivery by insertable medical devices Resverlogix, Inc (CA) 2011-04-27 EP disclosed
US-20090029987-A1 Pharmaceutical Compositions for the Prevention and Treatment of Complex Diseases and Their Delivery by Insertable Medical Devices RESVERLOGIX CORP. (CA) 2009-01-29 US disclosed
EP-1909788-A2 PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF COMPLEX DISEASES AND THEIR DELIVERY BY INSERTABLE MEDICAL DEVICES RESVERLOGIX CORP. (CA) 2008-04-16 EP disclosed
WO-2007016525-A2 PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF COMPLEX DISEASES AND THEIR DELIVERY BY INSERTABLE MEDICAL DEVICES RESVERLOGIX CORP. (CA) 2007-02-08 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-20090029987-A1 Pharmaceutical Compositions for the Prevention and Treatment of Complex Diseases and Their Delivery by Insertable Medical Devices VCAM1, ICAM1, TGFB1 GSK3B 3086/4885MEN1 3477/4885KMT2A 3207/4885

“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.