SCHEMBL1338403

SCHEMBL1338403

Cn1c(Nc2c(Cl)cccc2Cl)nc2cc(C(=O)Nc3cc(C4CC4)ccn3)ncc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.40
BRAF P15056 11/20 0.40
JAK2 O60674 4/20 0.38
TYK2 P29597 4/20 0.38
EGFR P00533 3/20 0.38
CDK2 P24941 1/20 0.38
KDR P35968 1/20 0.38
JAK1 P23458 1/20 0.38
CDK9 P50750 1/20 0.38
JAK3 P52333 1/20 0.38

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
SCHEMBL1338306 0.83 PTGES (0.51) PTGESBRAF
SCHEMBL1337866 0.81 PTGES (0.40) PTGESBRAFEGFRJAK3
SCHEMBL1336336 0.81 LCK (0.40) PTGESEGFRJAK3
SCHEMBL1337815 0.79 ALDH1A1 (0.48) PTGESBRAFEGFR
SCHEMBL1337813 0.79 CNR1 (0.48) PTGESBRAF
SCHEMBL1338208 0.79 PTGES (0.42) PTGESBRAFJAK2TYK2JAK1
SCHEMBL12130168 0.78 PTGES (0.53) PTGESBRAF
SCHEMBL1336677 0.76 PTGES (0.49) PTGES
SCHEMBL1337912 0.76 PTGES (0.57) PTGES
SCHEMBL13393760 0.76 PTGES (0.42) PTGESBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598190-B2 3H-imidazo [4, 5-C] pyridine-6-carboxamides as anti-inflammatory agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-12-03 US claimed
US-20110275656-A1 3H-Imidazo [4, 5-C] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US claimed
US-8598190-B2 3H-imidazo [4, 5-C] pyridine-6-carboxamides as anti-inflammatory agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-12-03 US disclosed
US-20110275656-A1 3H-Imidazo [4, 5-C] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US disclosed
US-20110275656-A1 3H-Imidazo [4, 5-C] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 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-20110275656-A1 3H-Imidazo [4, 5-C] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents MAP4, IL4, MAP7D3 PTGES 151/4885BRAF 967/4885JAK2 544/4885

“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.