SCHEMBL333269

SCHEMBL333269

C[C@H]1C[C@@](C#N)(C2C=CC(F)(Sc3ccc(-c4ccnn4C)cc3)C=C2)CCO1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.35
NAAA Q02083 1/20 0.33
USP30 Q70CQ3 1/20 0.31

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
SCHEMBL10245519 0.75 ALOX5 (0.37) ALOX5NAAA
SCHEMBL333270 0.74 ALOX5 (0.35) ALOX5NAAA
SCHEMBL10248320 0.74 ALOX5 (0.37) ALOX5NAAA
SCHEMBL332345 0.71 ALOX5 (0.42) ALOX5NAAAUSP30
SCHEMBL333240 0.70 ALOX5 (0.43) ALOX5NAAAUSP30
SCHEMBL332890 0.68 ALOX5 (0.38) ALOX5NAAA
SCHEMBL332739 0.68 ALOX5 (0.38) ALOX5NAAA
SCHEMBL12156883 0.68 ALOX5 (0.38) ALOX5NAAA
SCHEMBL3655644 0.68 ALOX5 (0.42) ALOX5NAAAUSP30
SCHEMBL10246935 0.68 NAAA (0.32) NAAA

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 2 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

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 1/4885NAAA 2503/4885USP30 2682/4885

“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.