SCHEMBL3382240

SCHEMBL3382240

Cc1nc(-c2ccccc2O)n(CCc2cccc(F)c2)c(=O)c1C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CASR P41180 20/20 1.00

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
SCHEMBL5797772 0.92 CASR (0.85) CASR
SCHEMBL3383171 0.88 CASR (1.00) CASR
SCHEMBL5797665 0.86 CASR (0.79) CASR
SCHEMBL3382473 0.86 CASR (0.76) CASR
SCHEMBL3379049 0.85 CASR (0.87) CASR
SCHEMBL5796090 0.84 CASR (0.73) CASR
SCHEMBL5822471 0.84 CASR (0.73) CASR
SCHEMBL3382006 0.84 CASR (1.00) CASR
SCHEMBL5823509 0.84 CASR (0.71) CASR
SCHEMBL5823507 0.84 CASR (0.71) CASR

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615897-B1 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMA INC (US) 2010-11-24 EP claimed
US-7491728-B2 Pyrimidinone compounds as calcilytics SMITHKLINE BEECHAM CORP. (US) 2009-02-17 US claimed
EP-1613606-A4 METHODS FOR PREPARING 2,3,5,6-SUBSTITUTED 3H-PYRIMIDIN-4-ONES NPS PHARMA INC (US) 2008-12-03 EP claimed
EP-1615897-A4 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMA INC (US) 2008-07-23 EP claimed
US-20070197555-A1 Pyrimidinone Compounds As Calcilytics GLAXOSMITHKLINE LLC 2007-08-23 US claimed
US-20070161792-A1 Methods for preparing 2,3,5,6-substituted 3h-pyrimidin-4-ones NPS PHARMACUETICALS, INC (US) 2007-07-12 US claimed
CN-1835928-A Pyrimidone compounds as calcium-sensitive receptor antagonists NPS PHARMA INC (US) 2006-09-20 CN claimed
WO-2006066070-A2 PRODRUG CONSTRUCTS OF PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2006-06-22 WO claimed
EP-1615897-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2006-01-18 EP claimed
EP-1613606-A2 METHODS FOR PREPARING 2,3,5,6-SUBSTITUTED 3H-PYRIMIDIN-4-ONES NPS PHARMACEUTICALS, INC. (US) 2006-01-11 EP claimed
WO-2004092121-A2 METHODS FOR PREPARING 2,3,5,6-SUBSTITUTED 3H-PYRIMIDIN-4-ONES NPS PHARMACEUTICALS, INC. (US) 2004-10-28 WO claimed
WO-2004092120-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2004-10-28 WO claimed
EP-1615897-B1 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMA INC (US) 2010-11-24 EP disclosed
US-7491728-B2 Pyrimidinone compounds as calcilytics SMITHKLINE BEECHAM CORP. (US) 2009-02-17 US disclosed
US-7491728-B2 Pyrimidinone compounds as calcilytics SMITHKLINE BEECHAM CORP. (US) 2009-02-17 US disclosed
US-7491728-B2 Pyrimidinone compounds as calcilytics SMITHKLINE BEECHAM CORP. (US) 2009-02-17 US disclosed
EP-1615897-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2006-01-18 EP disclosed
EP-1613606-A2 METHODS FOR PREPARING 2,3,5,6-SUBSTITUTED 3H-PYRIMIDIN-4-ONES NPS PHARMACEUTICALS, INC. (US) 2006-01-11 EP disclosed
WO-2004092121-A2 METHODS FOR PREPARING 2,3,5,6-SUBSTITUTED 3H-PYRIMIDIN-4-ONES NPS PHARMACEUTICALS, INC. (US) 2004-10-28 WO disclosed
WO-2004092120-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2004-10-28 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-20070197555-A1 Pyrimidinone Compounds As Calcilytics TYMP, DPYD, UMPS CASR 286/4885
US-20070161792-A1 Methods for preparing 2,3,5,6-substituted 3h-pyrimidin-4-ones TYMP, DPYD, DHFR CASR 4833/4885

“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.