SCHEMBL332479

SCHEMBL332479

Cn1nccc1Cc1ccc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.65
PIK3CD O00329 1/20 0.36
HRH3 Q9Y5N1 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ITGA4 P13612 1/20 0.31
ITGB7 P26010 1/20 0.31
F2 P00734 1/20 0.30
LMNA P02545 1/20 0.30
CYP26A1 O43174 1/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MAP3K14 Q99558 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
SCHEMBL332551 0.88 ALOX5 (0.54) ALOX5PIK3CDHRH3MAP3K14
Pf-4191834 SCHEMBL332973 0.85 ALOX5 (0.81) ALOX5PIK3CDHRH3
Pf-4191834 SCHEMBL29369341 0.85 ALOX5 (0.81) ALOX5PIK3CDHRH3
SCHEMBL333086 0.82 ALOX5 (0.61) ALOX5PIK3CDHRH3ALDH1A1LMNA
SCHEMBL332437 0.80 ALOX5 (0.63) ALOX5PIK3CDHRH3ALDH1A1USP2
SCHEMBL332424 0.79 ALOX5 (0.62) ALOX5PIK3CDHRH3
SCHEMBL332613 0.79 ALOX5 (0.62) ALOX5PIK3CDHRH3ALDH1A1
SCHEMBL7809017 0.79 ALOX5 (1.00) ALOX5PIK3CDHRH3ALDH1A1LMNA
SCHEMBL7814848 0.78 ALOX5 (1.00) ALOX5LMNA
SCHEMBL333095 0.78 ALOX5 (0.63) 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 1305/4885HRH3 4150/4885

“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.