SCHEMBL1338985

SCHEMBL1338985

O=C(Nc1cc(OC2CCCC2)ccn1)c1cc2[nH]c(Nc3c(Cl)cccc3Cl)nc2cn1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.43
ABL1 P00519 2/20 0.40
RAF1 P04049 7/20 0.39
BRAF P15056 6/20 0.39
PTGES O14684 3/20 0.38
JAK2 O60674 2/20 0.38
TYK2 P29597 2/20 0.38
KDR P35968 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL1337902 0.90 GRM5 (0.47) GRM5PTGESKDR
SCHEMBL1338208 0.84 PTGES (0.42) BRAFPTGESJAK2TYK2
SCHEMBL1337997 0.80 BRAF (0.47) RAF1BRAFPTGESKDR
SCHEMBL1337161 0.80 PTGES (0.48) RAF1BRAFPTGESKDR
SCHEMBL1338865 0.80 PTGES (0.44) PTGESJAK2TYK2
SCHEMBL12132139 0.80 PTGES (0.55) PTGESJAK2
SCHEMBL1338935 0.78 MAPT (0.39) RAF1BRAFPTGESKDRPDE4A
SCHEMBL1338996 0.78 PTGES (0.43) ABL1PTGES
SCHEMBL1336288 0.78 PTGES (0.43) ABL1PTGES
SCHEMBL1338433 0.78 PTGES (0.43) ABL1PTGESJAK2TYK2

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-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 GRM5 2657/4885ABL1 154/4885RAF1 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.