SCHEMBL2302106

SCHEMBL2302106

CC(C)C1CCC(NC(=O)c2cnc3c(c2)nc(Nc2c(Cl)cccc2Cl)n3C)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGES O14684 5/20 0.42
HPGDS O60760 1/20 0.40
EGFR P00533 1/20 0.39
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
ADORA2A P29274 1/20 0.38
NTRK1 P04629 1/20 0.38
NTRK3 Q16288 1/20 0.38
NTRK2 Q16620 1/20 0.38
TNKS O95271 1/20 0.38
TTK P33981 5/20 0.38
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
HPGD P15428 1/20 0.37
LRRK2 Q5S007 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 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
SCHEMBL2302105 1.00 PTGES (0.42) PTGESHPGDSEGFRDPP4DPP7
SCHEMBL2685469 0.92 PTGES (0.47) PTGESHPGDSDPP4DPP7ADORA2A
SCHEMBL10173505 0.92 PTGES (0.47) PTGESHPGDSDPP4DPP7ADORA2A
SCHEMBL2683689 0.90 PTGES (0.44) PTGESHPGDSADORA2ANTRK1NTRK3
SCHEMBL2683691 0.90 PTGES (0.44) PTGESHPGDSADORA2ANTRK1NTRK3
SCHEMBL2304335 0.88 HPGDS (0.48) PTGESHPGDS
SCHEMBL2301686 0.88 PTGES (0.42) PTGESHPGDSADORA2ANTRK1NTRK3
SCHEMBL10173433 0.87 PTGES (0.56) PTGES
SCHEMBL2690979 0.84 PTGES (0.52) PTGESNTRK1NTRK3NTRK2AURKA
SCHEMBL2690981 0.84 PTGES (0.52) PTGESNTRK1NTRK3NTRK2AURKA

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 6 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 claimed
EP-2350073-A1 3H-IMIDAZO[4,5-b]PYRIDINE-6-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-08-03 EP claimed
WO-2010034799-A1 3H-IMIDAZ0 [4, 5-B] PYRIDINE- 6 -CARBOXAMIDES AS ANTI -INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO claimed
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 132/4885HPGDS 427/4885EGFR 664/4885

“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.