SCHEMBL10173657

SCHEMBL10173657

CCOc1nc2[nH]c(Nc3c(Cl)cc(F)cc3Cl)nc2cc1C(=O)Nc1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 9/20 0.43
NPC1 O15118 2/20 0.39
TSHR P16473 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
MAPT P10636 3/20 0.37
HTT P42858 3/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 2/20 0.37
TP53 P04637 1/20 0.37
LMNA P02545 2/20 0.36
RECQL P46063 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL2683447 0.91 PTGES (0.43) PTGESNPC1TSHRTAS1R3TAS1R1
SCHEMBL2685749 0.90 PTGES (0.43) PTGES
SCHEMBL2685805 0.90 PTGES (0.51) PTGES
SCHEMBL16352219 0.85 PTGES (0.55) PTGESTAS1R3TAS1R1MAPTHTT
SCHEMBL10173627 0.85 CNR1 (0.39) PTGESLMNAMAPK1
SCHEMBL2303824 0.83 PTGES (0.42) PTGESALDH1A1
SCHEMBL2683863 0.82 PTGES (0.46) PTGESMAPTLMNASMN1; SMN2
SCHEMBL10173654 0.82 PTGES (0.48) PTGESNPC1TSHR
SCHEMBL2683909 0.82 PTGES (0.51) PTGES
SCHEMBL10173656 0.81 PTGES (0.40) PTGESKMT2AMEN1ALDH1A1GAA

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 3 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
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 PTGES 132/4885NPC1 4771/4885TSHR 3099/4885

“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.