SCHEMBL3369288

SCHEMBL3369288

O=C(O)N(CC1CCOCC1)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.43
PIK3CD O00329 1/20 0.42
S1PR3 Q99500 1/20 0.33
ALOX5 P09917 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL3373222 0.83 NSD2 (0.42) NSD2PIK3CDS1PR3ALOX5PSEN1
SCHEMBL3371459 0.79 NSD2 (0.45) NSD2PIK3CDS1PR3ALOX5PSEN1
SCHEMBL4962557 0.78 ALOX5 (0.36) S1PR3ALOX5SLC6A2SLC6A4
SCHEMBL4962560 0.78 ALOX5 (0.36) S1PR3ALOX5SLC6A2SLC6A4
SCHEMBL6119943 0.74 PIK3CD (0.51) PIK3CDS1PR3SLC6A2SLC6A4
SCHEMBL4909416 0.74 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL17621267 0.73 PIK3CD (0.40) NSD2PIK3CDS1PR3ALOX5KDM4E
SCHEMBL3495532 0.72 PIK3CD (0.45) PIK3CD
SCHEMBL5986789 0.71 PIK3CD (0.38) NSD2PIK3CDKDM4E
SCHEMBL5560613 0.70 SLC6A2 (0.44) S1PR3ALOX5SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863477-B1 3,4-SUBSTITUTED PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF HYPERTENSION NOVARTIS AG (CH) 2010-11-03 EP claimed
US-7807709-B2 Organic compounds NOVARTIS AG (CH) 2010-10-05 US claimed
US-20080194549-A1 Organic Compounds NOVARTIS AG (CH) 2008-08-14 US claimed
EP-1863477-A1 3,4-SUBSTITUTED PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF HYPERTENSION Novartis AG (CH) 2007-12-12 EP claimed
WO-2006100036-A1 3, 4-SUBSTITUTED PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF HYPERTENSION NOVARTIS AG (CH) 2006-09-28 WO claimed

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-20080194549-A1 Organic Compounds REN, ACE, OTC NSD2 4419/4885PIK3CD 1621/4885S1PR3 1971/4885

“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.