SCHEMBL332218

SCHEMBL332218

Cn1nccc1-c1ccc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)cc1C#N

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.59
PIK3CD O00329 2/20 0.39
SCN9A Q15858 1/20 0.35
RET P07949 1/20 0.33
NT5E P21589 1/20 0.32
HTR2A P28223 2/20 0.30
KCNH2 Q12809 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
USP30 Q70CQ3 1/20 0.30
HTR2C P28335 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
SCHEMBL332437 0.88 ALOX5 (0.63) ALOX5PIK3CDHTR2AHRH3HTR2C
SCHEMBL332613 0.87 ALOX5 (0.62) ALOX5PIK3CDHTR2AHRH3HTR2C
SCHEMBL332424 0.87 ALOX5 (0.62) ALOX5PIK3CDSCN9AHTR2AKCNH2
Pf-4191834 SCHEMBL29369341 0.85 ALOX5 (0.81) ALOX5PIK3CDHRH3
Pf-4191834 SCHEMBL332973 0.85 ALOX5 (0.81) ALOX5PIK3CDHRH3
SCHEMBL333909 0.85 ALOX5 (0.53) ALOX5PIK3CDSCN9ARETHRH3
SCHEMBL331647 0.85 ALOX5 (0.53) ALOX5PIK3CDRET
SCHEMBL15803498 0.78 ALOX5 (0.68) ALOX5PIK3CDKCNH2HRH3
SCHEMBL332268 0.78 ALOX5 (0.57) ALOX5PIK3CDHRH3
SCHEMBL333086 0.78 ALOX5 (0.61) ALOX5PIK3CDHRH3

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 9 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
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
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
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 1/4885PIK3CD 1305/4885SCN9A 3286/4885

“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.