SCHEMBL2947736

SCHEMBL2947736

CCOC(=O)CCC1CCN(C(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
HRH3 Q9Y5N1 4/20 0.37
RAB9A P51151 1/20 0.36
CYP1A2 P05177 1/20 0.36
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
CACNA1F O60840 1/20 0.36
CACNA1D Q01668 1/20 0.36
CACNA1S Q13698 1/20 0.36
CACNA1C Q13936 1/20 0.36
KCNH2 Q12809 2/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL5070236 0.86 ALDH1A1 (0.40) ALDH1A1TDP1USP2ALOX15LMNA
SCHEMBL2603283 0.84 POLB (0.38) POLBMAPTL3MBTL1HRH3KCNH2
SCHEMBL13515791 0.84 SMN1; SMN2 (0.40) ALDH1A1TSHRHRH3RAB9AKCNH2
SCHEMBL20088217 0.82 ALDH1A1 (0.40) ALDH1A1TDP1USP2ALOX15LMNA
SCHEMBL18623243 0.81 ALDH1A1 (0.50) ALDH1A1TDP1USP2ALOX15LMNA
SCHEMBL1721027 0.79 MAPT (0.43) ALDH1A1TDP1USP2ALOX15LMNA
SCHEMBL13745268 0.78 HRH3 (0.42) ALDH1A1MAPTHRH3KCNH2CYP2D6
SCHEMBL13282365 0.78 HRH3 (0.41) ALDH1A1HRH3KCNH2CYP2D6ATM
SCHEMBL7055400 0.78 ATM (0.41) ALDH1A1TDP1USP2ALOX15LMNA
SCHEMBL2648207 0.78 MEN1 (0.51) ALDH1A1TDP1USP2ALOX15LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1489078-B1 BENZOFURAN DERIVATIVE MITSUBISHI TANABE PHARMA CORP (JP) 2010-01-06 EP disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-7531537-B2 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-05-12 US disclosed
CN-100439351-C Benzofuran derivative TANABE SEIYAKU CO (JP) 2008-12-03 CN disclosed
US-7384952-B2 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-10 US disclosed
EP-1857459-A2 Pyrazolopyrimidine compound and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 2007-11-21 EP disclosed
CN-100345853-C Pyrazolopyrimidine compound and method for producing the same TANABE SEIYAKU CO (JP) 2007-10-31 CN disclosed
CN-1742013-A Pyrazolopyrimidine compound and method for producing the same TANABE SEIYAKU CO (JP) 2006-03-01 CN disclosed
US-20050282808-A1 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-12-22 US disclosed
EP-1585481-A2 PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2005-10-19 EP disclosed
CN-1656086-A Benzofuran derivative TANABE SEIYAKU CO (JP) 2005-08-17 CN disclosed
EP-1489078-A1 BENZOFURAN DERIVATIVE Tanabe Seiyaku Co., Ltd. (JP) 2004-12-22 EP disclosed
WO-2004064721-A2 A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2004-08-05 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 (2 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-20050282808-A1 Benzofuran derivative F12, F2, F11 ALDH1A1 683/4885TDP1 3656/4885USP2 4170/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 ALDH1A1 693/4885TDP1 3593/4885USP2 4174/4885

“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.