SCHEMBL4594061

SCHEMBL4594061

CC(C)(C)OC(=O)N[C@@H]1CCN(c2ncnc3c2oc2ccc(Cl)cc23)C1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 19/20 0.69
KDM4E B2RXH2 1/20 0.59
MAPT P10636 1/20 0.59
TSHR P16473 1/20 0.59
ALOX12 P18054 1/20 0.59
HSD17B10 Q99714 1/20 0.59
HRH3 Q9Y5N1 1/20 0.52

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
SCHEMBL4937146 1.00 HRH4 (0.69) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL4593794 1.00 HRH4 (0.69) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL4594114 0.93 HRH4 (0.67) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL4595148 0.86 HRH4 (0.75) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL4937137 0.86 HRH4 (0.75) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL4594943 0.86 HRH4 (0.75) HRH4KDM4EMAPTTSHRALOX12
SCHEMBL2167033 0.82 HRH4 (1.00) HRH4HRH3
SCHEMBL605620 0.82 HRH4 (1.00) HRH4HRH3
SCHEMBL606670 0.82 HRH4 (1.00) HRH4HRH3
SCHEMBL4594741 0.82 HRH4 (0.71) HRH4KDM4EMAPTTSHRALOX12

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-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
US-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
US-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
EP-1945646-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS Cellzome (UK) Ltd. (GB) 2008-07-23 EP disclosed
WO-2007039467-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS CELLZOME (UK) LTD. (GB) 2007-04-12 WO disclosed
EP-1767537-A1 Pyrimidine compounds for the treatment of inflammatory disorders Cellzome (UK) Ltd. (GB) 2007-03-28 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-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders HRH4, HRH3, HRH2 HRH4 1/4885KDM4E 1688/4885MAPT 2439/4885

“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.