SCHEMBL2686126

SCHEMBL2686126

O=C(O)c1cc2nc(Nc3c(Cl)cncc3Cl)[nH]c2nc1OC1CCOC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGES O14684 5/20 0.37
TYK2 P29597 3/20 0.37
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
DHODH Q02127 1/20 0.34
GRM4 Q14833 3/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
EGFR P00533 2/20 0.33
ITK Q08881 1/20 0.33
FGFR4 P22455 1/20 0.33

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
SCHEMBL2685676 0.91 PTGES (0.38) PTGESTYK2MAPK8MAPK9DHODH
SCHEMBL10173601 0.88 PTGES (0.42) PTGESTYK2MAPK8MAPK9DHODH
SCHEMBL2684076 0.86 PTGES (0.41) PTGESDHODHGRM4EGFRITK
SCHEMBL1977839 0.85 PTGES (0.39) PTGESTYK2MAPK8MAPK9EGFR
SCHEMBL2685971 0.85 ERBB2 (0.37) PTGESTYK2GRM4EGFR
SCHEMBL2686434 0.83 PTGES (0.38) PTGESTYK2DHODHIRAK4
SCHEMBL2683760 0.81 PTGES (0.41) PTGESDHODH
SCHEMBL2684463 0.78 CYP3A4 (0.35) PTGESGRM4EGFRITK
SCHEMBL2363380 0.77 PTGES (0.36) PTGESDHODH
SCHEMBL2363907 0.74 PTGES (0.36) PTGES

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-2350073-B1 3H-IMIDAZO[4,5-b]PYRIDINE-6-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INT (DE) 2014-11-12 EP disclosed
US-8703796-B2 3H-imidazo [4, 5-B] pyridine-6-carboxamides as anti-inflammatory agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-04-22 US disclosed
US-20120115902-A1 3H-Imidazo [4, 5-B] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-10 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-20120115902-A1 3H-Imidazo [4, 5-B] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents MAP4, MAPRE2, IL4 PTGES 132/4885TYK2 1079/4885MAPK8 215/4885

“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.