SCHEMBL2363636

SCHEMBL2363636

COc1nc2c(cc1C(=O)O)nc(Nc1c(Cl)cccc1Cl)n2C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.42
PTGES O14684 3/20 0.42
CLCN2 P51788 2/20 0.40
P2RX7 Q99572 1/20 0.40
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NOTUM Q6P988 1/20 0.38
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
EGFR P00533 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
FTO Q9C0B1 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
SCHEMBL2363954 0.91 LCK (0.46) LCKPTGESP2RX7MAPTMAPK1
SCHEMBL2359367 0.83 PTGES (0.47) PTGES
SCHEMBL2306105 0.81 LCK (0.38) LCKPTGESP2RX7EGFR
SCHEMBL1969613 0.81 IDH1 (0.46) LCKPTGESCLCN2P2RX7EGFR
SCHEMBL10173680 0.78 PTGES (0.54) PTGESP2RX7
SCHEMBL10173438 0.78 PTGES (0.51) PTGES
SCHEMBL2356672 0.76 PTGES (0.55) PTGESPOLB
SCHEMBL1966516 0.76 PTGES (0.51) PTGES
SCHEMBL2363517 0.76 EGFR (0.42) LCKEGFR
Formic Acid SCHEMBL2682895 0.76 PTGES (0.48) PTGES

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
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
EP-2350073-A1 3H-IMIDAZO[4,5-b]PYRIDINE-6-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-08-03 EP disclosed
WO-2010034799-A1 3H-IMIDAZ0 [4, 5-B] PYRIDINE- 6 -CARBOXAMIDES AS ANTI -INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO 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 LCK 1097/4885PTGES 132/4885CLCN2 3682/4885

“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.