SCHEMBL10173604

SCHEMBL10173604

CCNC(=O)c1cc2nc(Nc3c(Cl)cncc3Cl)[nH]c2nc1OCCOC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGES O14684 7/20 0.38
PDE4A P27815 4/20 0.34
PDE4B Q07343 4/20 0.34
PDE4C Q08493 4/20 0.34
PDE4D Q08499 4/20 0.34
CNR1 P21554 3/20 0.34
LRRK2 Q5S007 1/20 0.33
PIM1 P11309 1/20 0.33
BAD Q92934 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
LMNA P02545 1/20 0.33
CNR2 P34972 1/20 0.33
CCNE2 O96020 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32

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
SCHEMBL10173669 0.91 PTGES (0.40) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL2363907 0.89 PTGES (0.36) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL2363873 0.89 PTGES (0.36) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL10173603 0.88 PTGES (0.36) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL10173612 0.87 PTGES (0.41) PTGESCNR1CNR2
SCHEMBL2683766 0.86 PTGES (0.38) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL2303824 0.85 PTGES (0.42) PTGESPDE4APDE4BPDE4CPDE4D
SCHEMBL10173590 0.83 PTGES (0.43) PTGESCNR1CNR2
SCHEMBL2355679 0.83 PTGES (0.44) PTGES
SCHEMBL2363800 0.81 CNR1 (0.37) PTGESPDE4APDE4BPDE4CPDE4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 132/4885PDE4A 1207/4885PDE4B 2411/4885

“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.