SCHEMBL1337846

SCHEMBL1337846

Cn1c(Nc2c(Cl)cncc2Cl)nc2cc(C(=O)Nc3cc(C(F)(F)F)ccn3)ncc21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.49
BRAF P15056 9/20 0.46
RAF1 P04049 3/20 0.45
EPAS1 Q99814 1/20 0.41
GRM5 P41594 1/20 0.39
CBLB Q13191 1/20 0.39
LCK P06239 1/20 0.39
RIOK2 Q9BVS4 1/20 0.39
KDR P35968 1/20 0.39
ABL1 P00519 1/20 0.39
SRC P12931 1/20 0.39

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 0.93 PTGES (0.51) PTGESBRAFRAF1EPAS1RIOK2
SCHEMBL12130168 0.88 PTGES (0.53) PTGESBRAFRAF1EPAS1
SCHEMBL1338796 0.86 BRAF (0.47) PTGESBRAFRAF1GRM5CBLB
SCHEMBL1974213 0.80 BRAF (0.53) PTGESBRAFRAF1EPAS1LCK
SCHEMBL12131891 0.80 PTGES (0.46) PTGESBRAFRAF1EPAS1GRM5
SCHEMBL2686387 0.79 PTGES (0.49) PTGESBRAFEPAS1GRM5KDR
SCHEMBL10173666 0.79 PTGES (0.49) PTGESBRAFEPAS1LCKKDR
SCHEMBL1975355 0.79 PTGES (0.56) PTGESBRAF
SCHEMBL1338370 0.78 PTGES (0.44) PTGESBRAFRAF1EPAS1GRM5
SCHEMBL2683520 0.78 PTGES (0.48) PTGESBRAFEPAS1GRM5KDR

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-20110275656-A1 3H-Imidazo [4, 5-C] Pyridine- 6 -Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US claimed
EP-2361252-A1 3H-IMIDAZO [4, 5-C]PYRIDINE-6-CARBOXAMIDES AS ANTI -INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-08-31 EP claimed
WO-2010034798-A1 3H-IMIDAZO [4, 5-C] PYRIDINE-6-CARBOXAMIDES AS ANTI -INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO 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 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 967/4885RAF1 1237/4885

“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.