SCHEMBL1972248

SCHEMBL1972248

O=C(NCc1cc(C(F)(F)F)ccn1)c1ccc2[nH]c(Nc3c(Cl)cccc3Cl)nc2c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 9/20 0.44
TP53 P04637 1/20 0.43
KCNH2 Q12809 1/20 0.42
KLKB1 P03952 1/20 0.40
MAP4K1 Q92918 1/20 0.40
ALOX5 P09917 1/20 0.39
GLS O94925 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ROCK2 O75116 1/20 0.39

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
SCHEMBL1972329 0.88 PTGES (0.46) PTGESTP53ALOX5
SCHEMBL1977350 0.86 KDM4E (0.54) KDM4E
SCHEMBL1969871 0.85 HSD17B13 (0.46) PTGESTP53KCNH2GLS
SCHEMBL1971370 0.85 PTGES (0.47) PTGESALOX5
SCHEMBL1977047 0.83 HSD17B13 (0.44) PTGESKCNH2
SCHEMBL1974201 0.81 BRAF (0.45) PTGESTP53GLS
SCHEMBL16364076 0.80 PTGES (0.58) PTGESALOX5KDM4E
SCHEMBL13392964 0.80 MAPK14 (0.50) PTGESROCK2
SCHEMBL16364045 0.79 CYP3A4 (0.51) PTGESALOX5
SCHEMBL1966890 0.79 POLB (0.51) PTGESKDM4EROCK2

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
EP-2334652-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS Boehringer Ingelheim International GmbH (DE) 2011-06-22 EP claimed
US-8916599-B2 1H-benz imidazole-5-carboxamides as anti-inflammatory agents OREXO AB (SE) 2014-12-23 US disclosed
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 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-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 PTGES 118/4885TP53 595/4885KCNH2 2356/4885

“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.