SCHEMBL4003886

SCHEMBL4003886

CCNc1cc(Oc2cccc(NC(=O)O)c2)ncc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ JAK2 O60674 1/20 0.45
▸ HCAR3 P49019 1/20 0.43
▸ PDGFRB P09619 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ MAP2K7 O14733 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL4003892 1.00 MEN1 (0.48) MEN1KMT2AJAK2HCAR3PDGFRB
SCHEMBL4000397 0.88 MEN1 (0.44) MEN1KMT2AJAK2PDGFRBMAPT
SCHEMBL4717347 0.85 HCAR3 (0.46) MEN1KMT2AHCAR3PDGFRBMAPT
SCHEMBL4008389 0.83 ROCK1 (0.45) MAP2K7
SCHEMBL16493544 0.82 MAPT (0.42) MEN1KMT2AJAK2HCAR3PDGFRB
SCHEMBL16493542 0.82 MAPT (0.42) MEN1KMT2AJAK2HCAR3PDGFRB
SCHEMBL4002272 0.81 MEN1 (0.59) MEN1KMT2AJAK2HCAR3MAPT
SCHEMBL3999930 0.81 MAPT (0.51) MEN1KMT2AMAPT
SCHEMBL3999937 0.81 MAPT (0.51) MEN1KMT2AMAPT
SCHEMBL3998615 0.80 MEN1 (0.58) MEN1KMT2AJAK2HCAR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7547779-B2 Preparation of 1,6-disubstituted azabenzimidazoles as kinase inhibitors GLAXO GROUP LIMITED (GB) 2009-06-16 — — US disclosed
US-20080234261-A1 Preparation of 1,6-Disubstituted Azabenzimidazoles as Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-09-25 — — 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 (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-20080234261-A1 Preparation of 1,6-Disubstituted Azabenzimidazoles as Kinase Inhibitors TNK2, ROCK1, ARHGDIB MEN1 2478/4885KMT2A 1939/4885JAK2 570/4885

“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.

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