SCHEMBL332209

SCHEMBL332209

Cn1nccc1-c1ccc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.61
PIK3CD O00329 3/20 0.42
P2RX7 Q99572 1/20 0.38
ITGB2 P05107 1/20 0.37
ICAM1 P05362 1/20 0.37
ITGAL P20701 1/20 0.37
AKT1 P31749 3/20 0.37
ABL1 P00519 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
NT5E P21589 1/20 0.33
CD274 Q9NZQ7 1/20 0.32

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
SCHEMBL10193056 0.90 ALOX5 (0.48) ALOX5PIK3CDP2RX7ITGB2ICAM1
SCHEMBL332786 0.89 ALOX5 (0.61) ALOX5PIK3CDP2RX7AKT1ABL1
Pf-4191834 SCHEMBL29369341 0.87 ALOX5 (0.81) ALOX5PIK3CDP2RX7AKT1ABL1
Pf-4191834 SCHEMBL332973 0.87 ALOX5 (0.81) ALOX5PIK3CDP2RX7AKT1ABL1
SCHEMBL332613 0.85 ALOX5 (0.62) ALOX5PIK3CDP2RX7AKT1
SCHEMBL332268 0.82 ALOX5 (0.57) ALOX5PIK3CDP2RX7AKT1ABL1
SCHEMBL332437 0.80 ALOX5 (0.63) ALOX5PIK3CDAKT1
SCHEMBL333542 0.80 ALOX5 (0.56) ALOX5PIK3CDP2RX7ITGB2ICAM1
SCHEMBL15803498 0.79 ALOX5 (0.68) ALOX5PIK3CDP2RX7AKT1ABL1
SCHEMBL332424 0.79 ALOX5 (0.62) ALOX5PIK3CDAKT1

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 8 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

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 1305/4885P2RX7 358/4885

“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.