SCHEMBL332888

SCHEMBL332888

NC(=O)C1(c2cccc(Sc3cnc(Cl)c(Cl)c3)c2)CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.58
PIK3CD O00329 1/20 0.38
MAP4K4 O95819 1/20 0.37
ITGB2 P05107 1/20 0.34
ICAM1 P05362 1/20 0.34
ITGAL P20701 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
OPRL1 P41146 2/20 0.33
PTGDR Q13258 1/20 0.32
HDAC1 Q13547 1/20 0.32
P2RX7 Q99572 2/20 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
SCHEMBL332268 0.82 ALOX5 (0.57) ALOX5PIK3CDHRH3P2RX7
SCHEMBL332784 0.82 ALOX5 (0.53) ALOX5PIK3CDHRH3PTGDR
SCHEMBL13807413 0.81 ALOX5 (0.51) ALOX5PIK3CDHRH3OPRL1
SCHEMBL332895 0.81 ALOX5 (0.53) ALOX5PIK3CDHRH3
SCHEMBL333542 0.79 ALOX5 (0.56) ALOX5PIK3CDITGB2ICAM1ITGAL
SCHEMBL7654887 0.78 ALOX5 (0.68) ALOX5PIK3CDHRH3OPRL1HDAC1
SCHEMBL332613 0.77 ALOX5 (0.62) ALOX5PIK3CDHRH3P2RX7
SCHEMBL332226 0.76 ALOX5 (0.66) ALOX5PIK3CDHRH3HDAC1
SCHEMBL13201380 0.75 ALOX5 (0.58) ALOX5PIK3CDHRH3
SCHEMBL332599 0.75 ALOX5 (0.55) 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 4 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
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
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 1305/4885MAP4K4 2964/4885

“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.