SCHEMBL332793

SCHEMBL332793

C[C@H]1C[C@@](C(N)=O)(c2cccc(Sc3ccc(-c4ccnn4C)c(F)c3)c2F)CCO1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.42
HDAC4 P56524 3/20 0.33
AKT1 P31749 4/20 0.32
AKT2 P31751 1/20 0.32
HDAC9 Q9UKV0 2/20 0.30

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
SCHEMBL332552 0.89 ALOX5 (0.55) ALOX5HDAC4AKT1HDAC9
SCHEMBL332922 0.86 ALOX5 (0.48) ALOX5HDAC4AKT1AKT2
SCHEMBL333249 0.85 ALOX5 (0.45) ALOX5HDAC4AKT1AKT2HDAC9
SCHEMBL3660149 0.83 ALOX5 (0.40) ALOX5HDAC4
SCHEMBL332891 0.83
SCHEMBL332469 0.83 ALOX5 (0.47) ALOX5AKT1AKT2
SCHEMBL332455 0.79 ALOX5 (0.55) ALOX5AKT1AKT2
SCHEMBL332273 0.78 ALOX5 (0.34) ALOX5
SCHEMBL332517 0.77 ALOX5 (0.67) ALOX5HDAC4AKT1HDAC9
SCHEMBL332424 0.76 ALOX5 (0.62) ALOX5HDAC4AKT1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097733-B2 Pyrazole derivatives as 5-LO-inhibitors PFIZER INC. (US) 2012-01-17 US disclosed
US-8097733-B2 Pyrazole derivatives as 5-LO-inhibitors PFIZER INC. (US) 2012-01-17 US disclosed
EP-2225229-A1 PYRAZOLE DERIVATIVES AS 5-LO INHIBITORS Pfizer Inc. (US) 2010-09-08 EP disclosed
US-20090227634-A1 Pyrazole Derivatives as 5-LO-Inhibitors PFIZER INC. 2009-09-10 US disclosed
US-20090227634-A1 Pyrazole Derivatives as 5-LO-Inhibitors PFIZER INC. 2009-09-10 US disclosed
WO-2009069044-A1 PYRAZOLE DERIVATIVES AS 5-LO INHIBITORS PFIZER INC. (US) 2009-06-04 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-20090227634-A1 Pyrazole Derivatives as 5-LO-Inhibitors ALOX5, ALOX15, CYP3A5 ALOX5 1/4885HDAC4 3124/4885AKT1 3057/4885

“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.