SCHEMBL332725

SCHEMBL332725

Cn1nccc1-c1ccc(Sc2cccc(C3(C#N)CCOCC3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.53
PIK3CD O00329 3/20 0.42
KMT2A Q03164 1/20 0.36
NAAA Q02083 1/20 0.35
OTUD7B Q6GQQ9 3/20 0.34
USP30 Q70CQ3 2/20 0.33
CD274 Q9NZQ7 1/20 0.32
OPRM1 P35372 1/20 0.32
IDH1 O75874 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
SCHEMBL333240 0.88 ALOX5 (0.43) ALOX5PIK3CDKMT2ANAAAOTUD7B
SCHEMBL332522 0.87 ALOX5 (0.41) ALOX5PIK3CDKMT2AIDH1
SCHEMBL332559 0.83 PIK3CD (0.39) ALOX5PIK3CDKMT2AOPRM1IDH1
SCHEMBL332825 0.81 ALOX5 (0.49) ALOX5PIK3CDKMT2ANAAA
Pf-4191834 SCHEMBL332973 0.80 ALOX5 (0.81) ALOX5PIK3CDCD274
SCHEMBL3660567 0.79 ALOX5 (0.46) ALOX5PIK3CDNAAAOTUD7BUSP30
SCHEMBL3567445 0.79 ALOX5 (0.43) ALOX5PIK3CDKMT2A
SCHEMBL3565479 0.78 ALOX5 (0.42) ALOX5PIK3CDKMT2AOPRM1
SCHEMBL332628 0.78 ALOX5 (0.63) ALOX5PIK3CDCD274
SCHEMBL7811821 0.78 ALOX5 (0.42) ALOX5PIK3CDKMT2A

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 1305/4885KMT2A 3974/4885

“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.