SCHEMBL605403

SCHEMBL605403

CC(C)(C)CNc1cc(N2CC(N3CCCC3)C2)nc(N)n1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 17/20 0.69
NUDT1 P36639 3/20 0.48
KCNH2 Q12809 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45

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
SCHEMBL1775367 0.92 HRH4 (0.61) HRH4NUDT1KCNH2HRH3
SCHEMBL12605115 0.89 HRH4 (0.60) HRH4NUDT1KCNH2HRH3
SCHEMBL1774659 0.84 HRH4 (0.77) HRH4NUDT1KCNH2HRH3
SCHEMBL12605103 0.82 HRH4 (0.63) HRH4NUDT1KCNH2HRH3
SCHEMBL12605048 0.81 HRH4 (1.00) HRH4KCNH2HRH3
SCHEMBL12605095 0.81 HRH4 (0.73) HRH4NUDT1KCNH2HRH3
SCHEMBL1774257 0.81 HRH4 (0.73) HRH4NUDT1KCNH2HRH3
SCHEMBL5152060 0.81 HRH4 (0.73) HRH4NUDT1KCNH2HRH3
SCHEMBL1774905 0.81 HRH4 (0.63) HRH4NUDT1KCNH2HRH3
SCHEMBL605280 0.81 HRH4 (0.76) HRH4NUDT1KCNH2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966162-B1 PYRIMIDINE DERIVATIVES ZIARCO PHARMA LTD (GB) 2017-03-15 EP disclosed
US-9526725-B2 Selective histamine H4 receptor antagonists for the treatment of vestibular disorders INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2016-12-27 US disclosed
US-20120039913-A1 Selective Histamine H4 Receptor Antagonists for the Treatment of Vestibular Disorders INSERM (institut National de la Sante de la Recher Medicale) (FR) 2012-02-16 US disclosed
US-7943628-B2 Pyrimidine derivatives PFIZER LIMITED (GB) 2011-05-17 US disclosed
US-7943628-B2 Pyrimidine derivatives PFIZER LIMITED (GB) 2011-05-17 US disclosed
US-20070185075-A1 Pyrimidine derivatives PFIZER LIMITED 2007-08-09 US disclosed
US-20070185075-A1 Pyrimidine derivatives PFIZER LIMITED 2007-08-09 US 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-20070185075-A1 Pyrimidine derivatives TYMS, DPYD, TYMP HRH4 184/4885NUDT1 17/4885KCNH2 3180/4885

“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.