SCHEMBL333095

SCHEMBL333095

CCn1nccc1-c1ccc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.63
PIK3CD O00329 5/20 0.41
SLC13A5 Q86YT5 1/20 0.35
NR3C2 P08235 1/20 0.34
ABL1 P00519 1/20 0.33
DGAT1 O75907 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
ALK Q9UM73 1/20 0.31
SYK P43405 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
SCHEMBL332709 0.90 ALOX5 (0.62) ALOX5PIK3CDNR3C2DGAT1SYK
Pf-4191834 SCHEMBL332973 0.89 ALOX5 (0.81) ALOX5PIK3CDABL1HRH3
Pf-4191834 SCHEMBL29369341 0.89 ALOX5 (0.81) ALOX5PIK3CDABL1HRH3
SCHEMBL332323 0.88 ALOX5 (0.58) ALOX5PIK3CDHRH3
SCHEMBL332785 0.88 ALOX5 (0.59) ALOX5PIK3CDHRH3
SCHEMBL3663603 0.86 ALOX5 (0.64) ALOX5PIK3CDNR3C2HRH3
SCHEMBL332615 0.84 ALOX5 (0.59) ALOX5PIK3CDNR3C2
SCHEMBL332654 0.83 ALOX5 (0.58) ALOX5PIK3CDNR3C2
SCHEMBL332760 0.83 ALOX5 (0.58) ALOX5PIK3CDNR3C2
SCHEMBL15803498 0.81 ALOX5 (0.68) ALOX5PIK3CDSLC13A5ABL1HRH3

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 1305/4885SLC13A5 2215/4885

“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.