SCHEMBL6177040

SCHEMBL6177040

CCCCN1CCC(CNC(=O)c2ccc(N)n3cc(CCC)nc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 5/20 0.49
KCNH2 Q12809 1/20 0.45
NR4A2 P43354 1/20 0.44

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
SCHEMBL6761915 0.94 HTR4 (0.49) HTR4KCNH2NR4A2
SCHEMBL6764326 0.89 HTR4 (0.53) HTR4KCNH2NR4A2
SCHEMBL6770723 0.88 HTR4 (0.60) HTR4KCNH2
SCHEMBL6177156 0.86 HTR4 (0.59) HTR4KCNH2
SCHEMBL6175791 0.86 HTR4 (0.49) HTR4
Hydrochloric Acid SCHEMBL6765801 0.86 HTR4 (0.58) HTR4KCNH2
SCHEMBL6179088 0.85 KCNH2 (0.62) HTR4KCNH2NR4A2
SCHEMBL6177408 0.83 HTR4 (0.51) HTR4
SCHEMBL6177801 0.80 HTR4 (0.49) HTR4KCNH2
Hydrochloric Acid SCHEMBL6764321 0.79 HTR4 (0.48) HTR4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1440071-B1 IMIDAZOPYRIDINE COMPOUNDS AS 5-HT 4? RECEPTOR MODULATORS PFIZER (US) 2005-10-26 EP disclosed
US-20040034226-A1 Imidazopyridine compounds as 5-HT4 receptor modulators UCHIDA CHIKARA (JP) 2004-02-19 US disclosed
US-6624162-B2 5-HT4 receptor binding activity, and thus are useful for the treatment of gastroesophageal reflux disease, non-ulcer dyspepsia, Functional dyspepsia, irritable bowel syndrome or the like in mammalian, especially humans. PFIZER INC. 2003-09-23 US disclosed
US-20030092699-A1 Imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC. 2003-05-15 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 (2 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-20030092699-A1 Imidazopyridine compounds as 5-HT4 receptor modulators HTR4, HRH4, HRH2 HTR4 1/4885KCNH2 962/4885NR4A2 115/4885
US-20040034226-A1 Imidazopyridine compounds as 5-HT4 receptor modulators HRH4, HTR4, HRH2 HTR4 2/4885KCNH2 895/4885NR4A2 132/4885

“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.