SCHEMBL4166408

SCHEMBL4166408

Cc1c(F)ccc2[nH]c(-c3cnc4c(ccn4CCCC4CCN(C(=O)OC(C)(C)C)CC4)c3)nc12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 7/20 0.48
CHEK2 O96017 2/20 0.43
GPR119 Q8TDV5 1/20 0.42
PRMT5 O14744 3/20 0.40
PIK3CD O00329 1/20 0.39
ATR Q13535 1/20 0.38
TGFBR1 P36897 1/20 0.38

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
SCHEMBL4169743 0.88 HRH4 (0.46) HRH4CHEK2GPR119PRMT5
SCHEMBL3476997 0.79 HRH4 (0.47) HRH4CHEK2GPR119PRMT5
SCHEMBL4008933 0.77 GPR119 (0.47) GPR119
SCHEMBL4173927 0.77 GPR119 (0.46) GPR119
SCHEMBL604409 0.76 HRH4 (0.55) HRH4
SCHEMBL4169731 0.72 HRH4 (0.46) HRH4
SCHEMBL602354 0.72 HRH4 (0.57) HRH4
SCHEMBL2908130 0.70 HRH4 (0.79) HRH4
SCHEMBL605460 0.69 HRH4 (0.56) HRH4
SCHEMBL4006655 0.69 HRH4 (0.56) HRH4

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 1/4885CHEK2 2116/4885GPR119 377/4885

“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.