SCHEMBL10173656

SCHEMBL10173656

CCOc1nc2[nH]c(Nc3c(Cl)cc(F)cc3Cl)nc2cc1C(=O)Nc1cc(C(F)(F)F)ccn1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGES O14684 6/20 0.40
GRM5 P41594 1/20 0.39
IDH2 P48735 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
EPAS1 Q99814 1/20 0.37
SORT1 Q99523 1/20 0.37
RIOK2 Q9BVS4 1/20 0.36
BTK Q06187 3/20 0.36
GALK1 P51570 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
AR P10275 1/20 0.36

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
SCHEMBL2302514 0.93 PTGES (0.39) PTGESGRM5EPAS1SORT1RIOK2
SCHEMBL2355786 0.92 PTGES (0.42) PTGESGRM5IDH2ALDH1A1GAA
SCHEMBL2302457 0.91 PTGES (0.47) PTGESGRM5EPAS1SORT1RIOK2
SCHEMBL2685983 0.85 PTGES (0.41) PTGESGRM5EPAS1SORT1RIOK2
SCHEMBL2686563 0.84 PTGES (0.41) PTGESGRM5EPAS1SORT1BTK
SCHEMBL10173652 0.83 PTGES (0.49) PTGESGRM5IDH2ALDH1A1GAA
SCHEMBL2357387 0.83 PTGES (0.47) PTGESGRM5EPAS1SORT1RIOK2
SCHEMBL10173627 0.81 CNR1 (0.39) PTGES
SCHEMBL10173657 0.81 PTGES (0.43) PTGESALDH1A1GAAMEN1KMT2A
SCHEMBL10173628 0.79 PTGES (0.44) PTGESMEN1KMT2A

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 132/4885GRM5 2661/4885IDH2 425/4885

“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.