SCHEMBL3202763

SCHEMBL3202763

CC(C)(C)N(C(=O)O)[C@H]1CCN(c2cc(C3CCCCC3)nc(Cl)n2)C1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 16/20 0.41
HRH3 Q9Y5N1 3/20 0.34
HSD11B1 P28845 1/20 0.32
HTR6 P50406 1/20 0.32
TLR8 Q9NR97 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
SCHEMBL3197793 1.00 HRH4 (0.41) HRH4HRH3HSD11B1HTR6TLR8
SCHEMBL3196041 0.99 HRH4 (0.41) HRH4HRH3
SCHEMBL3195271 0.87 HRH4 (0.57) HRH4HRH3
SCHEMBL3206454 0.85 HRH4 (0.43) HRH4HRH3
SCHEMBL3209862 0.83 HRH4 (0.32) HRH4HRH3HSD11B1
SCHEMBL3199906 0.82 HRH4 (0.54) HRH4HRH3
SCHEMBL3205249 0.82 HRH4 (0.39) HRH4HSD11B1
SCHEMBL3199502 0.80 HRH4 (0.56) HRH4HRH3
SCHEMBL3207369 0.79 HRH4 (0.57) HRH4HRH3
SCHEMBL3196233 0.75 HRH4 (0.53) HRH4HRH3HSD11B1

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-20100035863-A1 2 Amino-Pyrimidine Derivatives As H4 Receptor Antagonists, Processes For Preparing Them And Their Use In Pharmaceutical Compositions UCB PHARMA, S.A. (BE) 2010-02-11 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-20100035863-A1 2 Amino-Pyrimidine Derivatives As H4 Receptor Antagonists, Processes For Preparing Them And Their Use In Pharmaceutical Compositions HRH4, HRH2, HRH3 HRH4 1/4885HRH3 3/4885HSD11B1 3530/4885

“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.