SCHEMBL6275571

SCHEMBL6275571

Cc1cn2c(N)c(Cl)cc(C(=O)NCC3CCN(CC(=O)C(C)(C)C)CC3)c2n1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.75
HTR4 Q13639 11/20 0.70
HTR3A P46098 1/20 0.70
CACNA1I Q9P0X4 2/20 0.55
DRD2 P14416 2/20 0.41
DRD4 P21917 2/20 0.41
DRD3 P35462 2/20 0.41

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
SCHEMBL6246866 0.90 KCNH2 (0.61) KCNH2HTR4HTR3ACACNA1IDRD2
SCHEMBL5889579 0.89 KCNH2 (0.77) KCNH2HTR4HTR3ACACNA1IDRD2
SCHEMBL6246478 0.89 KCNH2 (0.76) KCNH2HTR4HTR3ACACNA1IDRD2
SCHEMBL6314948 0.86 KCNH2 (0.81) KCNH2HTR4HTR3ACACNA1I
SCHEMBL6703834 0.86 KCNH2 (0.73) KCNH2HTR4HTR3ADRD2DRD4
SCHEMBL5889452 0.86 KCNH2 (0.73) KCNH2HTR4HTR3ADRD2DRD4
SCHEMBL5889425 0.86 KCNH2 (1.00) KCNH2HTR4HTR3ACACNA1I
SCHEMBL6703982 0.85 KCNH2 (0.74) KCNH2HTR4HTR3A
SCHEMBL6178204 0.85 KCNH2 (0.76) KCNH2HTR4HTR3A
SCHEMBL6703420 0.85 HTR4 (0.71) KCNH2HTR4HTR3ADRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951867-B2 N-substituted piperidinyl-imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC. (US) 2005-10-04 US claimed
US-20040127514-A1 N-substituted piperidinyl-imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC 2004-07-01 US claimed
US-6951867-B2 N-substituted piperidinyl-imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC. (US) 2005-10-04 US disclosed
EP-1543004-A1 N-SUBSTITUTED PIPERIDINYL-IMIDAZOPYRIDINE COMPOUNDS AS 5-HT4 RECEPTOR MODULATORS PFIZER INC. (US) 2005-06-22 EP disclosed
US-20040127514-A1 N-substituted piperidinyl-imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC 2004-07-01 US disclosed
WO-2004026868-A1 N-SUBSTITUTED PIPERIDINYL-IMIDAZOPYRIDINE COMPOUNDS AS 5-HT4 RECEPTOR MODULATORS PFIZER JAPAN INC. (JP) 2004-04-01 WO 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-20040127514-A1 N-substituted piperidinyl-imidazopyridine compounds as 5-HT4 receptor modulators HTR4, HRH4, HRH2 KCNH2 1390/4885HTR4 1/4885HTR3A 35/4885

“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.