SCHEMBL4171398

SCHEMBL4171398

Cc1c(-c2nc3ccc(F)c(C)c3[nH]2)ccc2c1ncn2CCCC1CCN(C)CC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.47
PRPS1 P60891 7/20 0.38
JAK1 P23458 1/20 0.36
NPY1R P25929 1/20 0.34

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
SCHEMBL4162361 0.92 PRPS1 (0.41) HRH4PRPS1JAK1NPY1R
SCHEMBL4161537 0.88 GPR119 (0.41) HRH4
SCHEMBL602350 0.87 HRH4 (0.62) HRH4
SCHEMBL606087 0.82 HRH4 (0.60) HRH4PRPS1
SCHEMBL605439 0.81 HRH4 (0.47) HRH4PRPS1NPY1R
SCHEMBL603867 0.80 HRH4 (0.51) HRH4
SCHEMBL12057121 0.80 HRH4 (0.57) HRH4PRPS1
SCHEMBL604413 0.80 HRH4 (0.46) HRH4PRPS1JAK1NPY1R
SCHEMBL605908 0.79 HRH4 (0.60) HRH4PRPS1NPY1R
SCHEMBL604047 0.78 HRH4 (0.49) HRH4PRPS1NPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084466-B2 Bicyclic heteroaryl-substituted imidazoles as modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA NV (BE) 2011-12-27 US disclosed
US-20090156613-A1 Bicyclic heteroaryl-substituted imidazoles as modulators of the histamine H4 receptor KINDRACHUK DAVID E 2009-06-18 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-20090156613-A1 Bicyclic heteroaryl-substituted imidazoles as modulators of the histamine H4 receptor HRH4, HRH3, HRH1 HRH4 1/4885PRPS1 3948/4885JAK1 1683/4885

“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.