SCHEMBL6070792

SCHEMBL6070792

O=C(NCc1cc(F)ccc1F)c1ccc2[nH]c3c(ccc4cn[nH]c43)c2c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 15/20 0.49
ROCK1 Q13464 7/20 0.49
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
MAOB P27338 2/20 0.40
KLKB1 P03952 1/20 0.39
MAP4K1 Q92918 1/20 0.39
FLT3 P36888 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
SCHEMBL6070867 0.90 ROCK2 (0.48) ROCK2ROCK1POLBMAPT
SCHEMBL6071406 0.87 MAOB (0.48) ROCK2POLBMAPTMAOB
SCHEMBL5409145 0.82 ROCK2 (0.58) ROCK2ROCK1MAOBKLKB1MAP4K1
SCHEMBL6070463 0.81 IMPDH2 (0.54) ROCK2ROCK1MAPTMAOB
SCHEMBL6070912 0.81 MAPK1 (0.51) ROCK2ROCK1MAOB
SCHEMBL6071307 0.78 MAOB (0.41) MAOB
SCHEMBL6071038 0.78 MAOB (0.39) ROCK2MAPTMAOB
SCHEMBL6071398 0.78 MAPT (0.53) POLBMAPT
SCHEMBL6071553 0.77 ITK (0.51) MAPTFLT3
SCHEMBL6070577 0.77 KDM4E (0.55) POLBMAPTMAOBFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2006-11-23 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-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K1, MAP3K19, MAP3K20 ROCK2 698/4885ROCK1 604/4885POLB 1184/4885

“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.