SCHEMBL1338997

SCHEMBL1338997

O=C(Nc1cc(C(F)(F)F)ccn1)c1cc2[nH]c(Nc3c(Cl)cc(F)cc3Cl)nc2cn1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.42
RAF1 P04049 3/20 0.42
GRM5 P41594 1/20 0.42
PTGES O14684 8/20 0.42
KDR P35968 1/20 0.41
DYRK1A Q13627 2/20 0.40
DYRK1B Q9Y463 1/20 0.39
EPAS1 Q99814 1/20 0.39
GALK1 P51570 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
SCHEMBL1338399 0.96 PTGES (0.43) BRAFRAF1GRM5PTGESKDR
SCHEMBL1337161 0.92 PTGES (0.48) BRAFRAF1PTGESKDRDYRK1A
SCHEMBL1338370 0.92 PTGES (0.44) BRAFRAF1GRM5PTGESKDR
SCHEMBL1337365 0.90 PTGES (0.53) BRAFRAF1PTGESEPAS1
SCHEMBL1337925 0.87 PTGES (0.45) BRAFRAF1PTGESKDRDYRK1A
SCHEMBL1338989 0.86 BRAF (0.45) BRAFRAF1PTGESKDRDYRK1A
SCHEMBL12131891 0.85 PTGES (0.46) BRAFRAF1GRM5PTGESKDR
SCHEMBL1337997 0.83 BRAF (0.47) BRAFRAF1PTGESKDR
SCHEMBL12131892 0.81 PTGES (0.44) BRAFRAF1PTGESKDRDYRK1A
SCHEMBL1338738 0.80 PTGES (0.45) BRAFRAF1PTGESKDR

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-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

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 BRAF 967/4885RAF1 1237/4885GRM5 2657/4885

“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.