SCHEMBL5781982

SCHEMBL5781982

CC1(C)CCC(Cl)C(=O)NC1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
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

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
SCHEMBL3545714 0.79 SMN1; SMN2 (0.30)
SCHEMBL3278632 0.76
SCHEMBL14170465 0.73 CCR2 (0.35) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9187193 0.68 PSEN1 (0.31) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4669859 0.66
SCHEMBL1720682 0.66
SCHEMBL4669725 0.66
SCHEMBL33526130 0.64
SCHEMBL6704381 0.63
SCHEMBL6060170 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539747-B1 N-AROYL CYCLIC AMINES AS OREXIN RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2006-11-02 EP disclosed
US-20060040937-A1 N-aroyl cyclic amines as orexin receptor antagonists GLAXO GROUP LIMITED (GB) 2006-02-23 US disclosed
EP-1539747-A1 N-AROYL CYCLIC AMINES AS OREXIN RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2005-06-15 EP disclosed
WO-2004026866-A1 N-AROYL CYCLIC AMINES AS OREXIN RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2004-04-01 WO disclosed
EP-0361791-B1 Azacyclic derivatives useful as medicaments SMITHKLINE BEECHAM FARMA (IT) 1995-11-08 EP disclosed
US-5089507-A Also diuretic; long lasting, side effect reduction DR. L. ZAMBELETTI SPA (IT) 1992-02-18 US disclosed
EP-0447704-A1 N-Acylated azacyclic compounds, processes for their preparations and their use as medications Smithkline Beecham Farmaceutici S.p.A. (IT) 1991-09-25 EP disclosed
EP-0361791-A2 Azacyclic derivatives useful as medicaments Smithkline Beecham Farmaceutici S.p.A. (IT) 1990-04-04 EP 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-20060040937-A1 N-aroyl cyclic amines as orexin receptor antagonists HCRTR2, HCRTR1, NTSR2 PSEN1 1307/4885PSEN2 1168/4885APH1B 670/4885

“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.