SCHEMBL6027461

SCHEMBL6027461

Nc1ccc(-c2ncc(-c3cccc(N)c3)[nH]2)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 9/20 0.56
NPY5R Q15761 7/20 0.56
HPGDS O60760 3/20 0.50
MAP4K4 O95819 2/20 0.47

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
SCHEMBL6887923 0.94 SCN2A (0.56) SCN2ANPY5RHPGDSMAP4K4
SCHEMBL6885064 0.92 SCN2A (0.59) SCN2ANPY5RHPGDSMAP4K4
SCHEMBL6026939 0.84 NPY5R (0.64) SCN2ANPY5RHPGDS
SCHEMBL4056971 0.80 MASP2 (0.67) SCN2AMAP4K4
Hydrochloric Acid SCHEMBL4053943 0.78 MASP2 (0.65) SCN2AMAP4K4
SCHEMBL7981198 0.77 CYP2A6 (0.56) NPY5RMAP4K4
SCHEMBL31614566 0.77 SCN2A (0.73) SCN2ANPY5RHPGDS
SCHEMBL27723892 0.77 SCN2A (0.59) SCN2ANPY5RHPGDS
SCHEMBL20812633 0.76 KDM4E (0.50) MAP4K4
SCHEMBL17283469 0.75 SCN2A (0.96) SCN2ANPY5RHPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1613310-A1 IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALLERGIC AND HYPERPROLIFERATIVE DISORDERS Avanir Pharmaceuticals (US) 2006-01-11 EP disclosed
US-20040229927-A1 Imidazole derivatives for treatment of allergic and hyperproliferative disorders AVANIR PHARMACEUTICALS 2004-11-18 US disclosed
WO-2004091610-A1 IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALLERGIC AND HYPERPROLIFERATIVE DISORDERS AVANIR PHARMACEUTICALS (US) 2004-10-28 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-20040229927-A1 Imidazole derivatives for treatment of allergic and hyperproliferative disorders ICOS, TSLP, IKZF3 SCN2A 4668/4885NPY5R 4342/4885HPGDS 69/4885

“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.