SCHEMBL10246701

SCHEMBL10246701

C[C@H]1C[C@@](C(N)=O)(C2CC=CC(Sc3ccc(-c4ccnn4C)cc3)=C2F)CCO1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.48
AKT1 P31749 4/20 0.31
CD274 Q9NZQ7 1/20 0.30
AKT2 P31751 3/20 0.30
JAK3 P52333 2/20 0.30
JAK1 P23458 1/20 0.30
SGK1 O00141 1/20 0.30
ROCK2 O75116 1/20 0.30
RPS6KB1 P23443 1/20 0.30
PRKCQ Q04759 1/20 0.30
ROCK1 Q13464 1/20 0.30
RPS6KA1 Q15418 1/20 0.30
AKT3 Q9Y243 1/20 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
SCHEMBL13807053 0.89 ALOX5 (0.36) ALOX5AKT1AKT2
SCHEMBL10246842 0.89 ALOX5 (0.36) ALOX5AKT1AKT2
SCHEMBL10246610 0.86 ALOX5 (0.47) ALOX5AKT1CD274AKT2
SCHEMBL10248385 0.83 ALOX5 (0.49) ALOX5CD274
SCHEMBL10245519 0.82 ALOX5 (0.37) ALOX5
SCHEMBL10247144 0.80 ALOX5 (0.47) ALOX5AKT1CD274AKT2JAK3
SCHEMBL10245508 0.78 ALOX5 (0.47) ALOX5AKT1CD274AKT2
SCHEMBL10248086 0.74 ALOX5 (0.36) ALOX5AKT1AKT2
SCHEMBL332120 0.73 ALOX5 (0.61) ALOX5AKT1CD274AKT2JAK3
SCHEMBL332552 0.73 ALOX5 (0.55) ALOX5AKT1CD274JAK3JAK1

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-8097733-B2 Pyrazole derivatives as 5-LO-inhibitors PFIZER INC. (US) 2012-01-17 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 1/4885AKT1 3057/4885CD274 2601/4885

“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.