SCHEMBL6094685

SCHEMBL6094685

Cc1nc(Oc2ccccc2)c([N+](=O)[O-])c(NCCC2CCN(Cc3ccccc3)CC2)c1C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.46
ACHE P22303 5/20 0.44
BCHE P06276 2/20 0.43

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
SCHEMBL6096912 0.87 ACHE (0.48) CHRM4ACHEBCHE
SCHEMBL6095659 0.85 ACHE (0.49) CHRM4ACHEBCHE
SCHEMBL6095643 0.79 CHRM4 (0.48) CHRM4ACHEBCHE
SCHEMBL5333576 0.77 MAPT (0.42)
SCHEMBL4766860 0.77 LMNA (0.41)
Hydrochloric Acid SCHEMBL4773467 0.77 PIN1 (0.40)
SCHEMBL4768129 0.77 PIN1 (0.40)
SCHEMBL4773614 0.76 MAPT (0.47)
SCHEMBL4829956 0.76 MAPT (0.41)
SCHEMBL4765985 0.76 PIN1 (0.39)

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098221-B2 Amide substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-29 US disclosed
US-20050282854-A1 Amide substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2005-12-22 US disclosed
US-6969722-B2 Amide substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-11-29 US disclosed
US-6903113-B2 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-06-07 US disclosed
US-6878719-B2 Sulfonamido substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-04-12 US disclosed
EP-1453829-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-08 EP disclosed
EP-1451186-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-01 EP disclosed
EP-1451187-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-01 EP disclosed
US-20040157879-A1 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-08-12 US disclosed
US-20040147533-A1 Sulfonamido substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-07-29 US disclosed
US-20040019076-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2004-01-29 US disclosed
US-20030195209-A1 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-10-16 US disclosed
US-20030186949-A1 Amide substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-10-02 US disclosed
US-20030162806-A1 Amide substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-08-28 US disclosed
WO-2003050118-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
WO-2003050117-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
WO-2003050119-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed
US-6545016-B1 Inducing cytokine biosynthesis; treating a viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY 2003-04-08 US disclosed
US-6545017-B1 Inducing cytokine biosynthesis; treating a viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY 2003-04-08 US disclosed
US-6525064-B1 Immune response modifiers; can induce the biosynthesis of various cytokines; 3M INNOVATIVE PROPERTIES COMPANY 2003-02-25 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 (7 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-20030195209-A1 Urea substituted imidazopyridines EIF2AK2, UMPS, IRF3 CHRM4 3574/4885ACHE 3774/4885BCHE 3465/4885
US-20050282854-A1 Amide substituted imidazopyridines IRF3, EIF2AK2, IFNG CHRM4 3586/4885ACHE 4558/4885BCHE 4341/4885
US-20040157879-A1 Urea substituted imidazopyridines EIF2AK2, UMPS, IRF3 CHRM4 3574/4885ACHE 3774/4885BCHE 3465/4885
US-20040147533-A1 Sulfonamido substituted imidazopyridines IRF3, EIF2AK2, MYD88 CHRM4 4313/4885ACHE 4812/4885BCHE 4659/4885
US-20030162806-A1 Amide substituted imidazopyridines IRF3, EIF2AK2, IFNG CHRM4 3586/4885ACHE 4558/4885BCHE 4341/4885
US-20040019076-A1 SULFONAMIDO SUBSTITUTED IMIDAZOPYRIDINES IRF3, EIF2AK2, MYD88 CHRM4 4313/4885ACHE 4812/4885BCHE 4659/4885
US-20030186949-A1 Amide substituted imidazopyridines IRF3, EIF2AK2, IFNG CHRM4 3586/4885ACHE 4558/4885BCHE 4341/4885

“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.