SCHEMBL6180780

SCHEMBL6180780

CCc1cn2c(N)c(Cl)cc(C(=O)NCC3CCN(CCCOC)CC3)c2n1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.60
HTR4 Q13639 15/20 0.55
HTR3A P46098 1/20 0.55
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
Hydrochloric Acid SCHEMBL6770784 0.99 KCNH2 (0.59) KCNH2HTR4HTR3ACYP3A4CYP2D6
SCHEMBL6767167 0.92 KCNH2 (0.62) KCNH2HTR4HTR3A
SCHEMBL6177604 0.90 KCNH2 (0.74) KCNH2HTR4HTR3ACYP3A4CYP2D6
SCHEMBL6765012 0.88 HTR4 (0.57) KCNH2HTR4HTR3A
SCHEMBL5889439 0.87 KCNH2 (0.61) KCNH2HTR4HTR3A
SCHEMBL8345408 0.87 KCNH2 (0.68) KCNH2HTR4HTR3A
SCHEMBL6179088 0.87 KCNH2 (0.62) KCNH2HTR4HTR3A
SCHEMBL5889424 0.86 KCNH2 (0.59) KCNH2HTR4HTR3A
SCHEMBL6177156 0.85 HTR4 (0.59) KCNH2HTR4CYP3A4CYP2D6
SCHEMBL5889899 0.85 KCNH2 (0.62) KCNH2HTR4HTR3A

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 KCNH2 962/4885HTR4 1/4885HTR3A 28/4885
US-20040034226-A1 Imidazopyridine compounds as 5-HT4 receptor modulators HRH4, HTR4, HRH2 KCNH2 895/4885HTR4 2/4885HTR3A 27/4885

“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.