SCHEMBL4392707

SCHEMBL4392707

Nc1nc(NCc2ccccc2)cc(N2CC[C@H](CNC(=O)O)C2)n1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 18/20 0.64
PIK3CB P42338 1/20 0.57
HRH3 Q9Y5N1 3/20 0.48
KCNH2 Q12809 1/20 0.48
NAPEPLD Q6IQ20 1/20 0.46

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
SCHEMBL1775730 0.83 HRH4 (0.67) HRH4PIK3CBHRH3
SCHEMBL4393795 0.82 RBP4 (0.43) HRH4HRH3KCNH2
SCHEMBL6023051 0.82 USP2 (0.52) HRH4
SCHEMBL1774807 0.81 HRH4 (0.52) HRH4PIK3CB
SCHEMBL4392709 0.80 HRH4 (0.66) HRH4PIK3CBHRH3
SCHEMBL5076737 0.79 LMNA (0.55) HRH4HRH3KCNH2
SCHEMBL1775505 0.79 LMNA (0.55) HRH4HRH3KCNH2
SCHEMBL6023878 0.79 LMNA (0.55) HRH4HRH3KCNH2
SCHEMBL1775871 0.79 HRH4 (0.57) HRH4PIK3CBHRH3KCNH2
SCHEMBL1775312 0.77 HRH4 (0.53) HRH4HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity PALAU PHARMA, S.A. (ES) 2009-12-10 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-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity HRH4, HRH2, HRH3 HRH4 1/4885PIK3CB 2077/4885HRH3 3/4885

“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.