SCHEMBL14082182

SCHEMBL14082182

O=C(Nc1ccncc1)c1ccc(-c2ccccn2)cc1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.76
POLB P06746 2/20 0.70
STAT3 P40763 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
JAK2 O60674 1/20 0.69
TYK2 P29597 1/20 0.69
KDM4E B2RXH2 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
PTPN2 P17706 1/20 0.61
PTPN1 P18031 1/20 0.61
HTT P42858 1/20 0.59
NT5E P21589 1/20 0.56
KMT2A Q03164 1/20 0.56
NAMPT P43490 1/20 0.56
MCHR1 Q99705 1/20 0.56

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
SCHEMBL14082180 0.91 TRPV1 (0.75) TRPV1POLBSTAT3SMN1; SMN2JAK2
SCHEMBL18573396 0.88 TRPV1 (0.71) TRPV1PTPN2PTPN1KMT2AMCHR1
SCHEMBL14082247 0.86 TRPV1 (1.00) TRPV1PTPN2PTPN1
SCHEMBL10452121 0.86 TRPV1 (0.76) TRPV1SMN1; SMN2KDM4EPTPN2PTPN1
SCHEMBL14313610 0.86 TRPV1 (0.72) TRPV1SMN1; SMN2KDM4EL3MBTL1PTPN2
SCHEMBL14082181 0.86 TRPV1 (0.76) TRPV1POLBPTPN2PTPN1KMT2A
SCHEMBL18573213 0.85 TRPV1 (0.71) TRPV1PTPN2PTPN1MCHR1
SCHEMBL14082187 0.85 NAMPT (0.72) TRPV1PTPN2PTPN1NAMPT
SCHEMBL3873012 0.83 TRPV1 (1.00) TRPV1
SCHEMBL29013035 0.83 POLB (1.00) TRPV1POLBSTAT3SMN1; SMN2JAK2

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
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 TRPV1 1/4885POLB 4543/4885STAT3 1861/4885

“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.