SCHEMBL5735841

SCHEMBL5735841

COc1ccc(-c2nc3c(c(N4CCOCC4)n2)CCC3)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.56
PIK3CD O00329 2/20 0.49
PIK3C2B O00750 2/20 0.49
PIK3CB P42338 2/20 0.49
MTOR P42345 6/20 0.47
APP P05067 1/20 0.46
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
NR4A1 P22736 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TLR9 Q9NR96 1/20 0.45
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
NOS1 P29475 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL5735026 0.89 ACHE (0.52) PIK3CAACHELMNATSHRNR4A1
SCHEMBL5735962 0.81 KDM4E (0.48) PIK3CAMTORLMNATSHRTLR9
SCHEMBL10150263 0.80 LMNA (0.56) PIK3CAMTORLMNATSHRTLR9
SCHEMBL5733280 0.76 LMNA (0.57) APPBCHEACHELMNASMN1; SMN2
SCHEMBL5733333 0.75 KDM4E (0.56) PIK3CAPIK3CDMTORACHELMNA
SCHEMBL6736048 0.75 PIK3CA (0.66) PIK3CAPIK3CDPIK3CBMTORTSHR
SCHEMBL5735126 0.74 HRH2 (0.51) BCHEACHETSHRSMN1; SMN2KDM4E
SCHEMBL16179431 0.74 HRH2 (0.58) BCHEACHETSHRSMN1; SMN2KDM4E
SCHEMBL5733821 0.74 HRH2 (0.51) BCHEACHETSHRSMN1; SMN2KDM4E
SCHEMBL8297550 0.72 PIK3CA (0.57) PIK3CAPIK3CDMTORTSHRKDM4E

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-7138398-B2 Substituted 4-amino-2-arylcyclopenta[d]pyrimidines, their preparation, their use and pharmaceutical preparations comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-11-21 US disclosed
EP-1131302-B1 SUBSTITUTED 4-AMINO-2-ARYL-CYCLOPENTA [D]PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME SANOFI AVENTIS DEUTSCHLAND (DE) 2006-02-01 EP disclosed
US-20040048850-A1 Substituted 4-amino-2-arylcyclopenta[d]pyrimidines, their preparation, their use and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH 2004-03-11 US disclosed
US-6627628-B1 Cardiovascular diseases such as hypertension, angina pectoris, heart failure, thrombosis and atherosclerosis. The compounds of formula (I) are able to modulate the body's own production of cyclic guanosine monophosphate (cGMP) and are suitable for AVENTIS PHARMA DEUTSCHLAND, GMBH (DE) 2003-09-30 US disclosed
EP-1131302-A1 SUBSTITUTED 4-AMINO-2-ARYL-CYCLOPENTA D]PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICALREPARATIONS CONTAINING SAME Aventis Pharma Deutschland GmbH (DE) 2001-09-12 EP disclosed
WO-2000031047-A1 SUBSTITUTED 4-AMINO-2-ARYL-CYCLOPENTA[D]PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICALREPARATIONS CONTAINING SAME AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-06-02 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-20040048850-A1 Substituted 4-amino-2-arylcyclopenta[d]pyrimidines, their preparation, their use and pharmaceutical preparations comprising them PDE3A, PDE2A, NPR1 PIK3CA 190/4885PIK3CD 377/4885PIK3C2B 1339/4885

“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.