SCHEMBL332437

SCHEMBL332437

Cc1cc(Sc2cccc(C3(C(N)=O)CCOCC3)c2)ccc1-c1ccnn1C

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.63
PIK3CD O00329 3/20 0.41
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
HRH3 Q9Y5N1 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
DRD1 P21728 1/20 0.31
AKT1 P31749 1/20 0.31
JAK1 P23458 2/20 0.31
JAK3 P52333 1/20 0.31
TYK2 P29597 1/20 0.31

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
SCHEMBL332424 0.90 ALOX5 (0.62) ALOX5PIK3CDHRH3HTR2AHTR2C
SCHEMBL332613 0.90 ALOX5 (0.62) ALOX5PIK3CDHRH3ALDH1A1HTR2A
Pf-4191834 SCHEMBL29369341 0.89 ALOX5 (0.81) ALOX5PIK3CDHRH3AKT1JAK1
Pf-4191834 SCHEMBL332973 0.89 ALOX5 (0.81) ALOX5PIK3CDHRH3AKT1JAK1
SCHEMBL332218 0.88 ALOX5 (0.59) ALOX5PIK3CDHRH3HTR2AHTR2C
SCHEMBL15803498 0.81 ALOX5 (0.68) ALOX5PIK3CDHRH3AKT1JAK1
SCHEMBL332268 0.80 ALOX5 (0.57) ALOX5PIK3CDHRH3AKT1JAK1
SCHEMBL333086 0.80 ALOX5 (0.61) ALOX5PIK3CDHRH3USP2ALDH1A1
SCHEMBL332786 0.80 ALOX5 (0.61) ALOX5PIK3CDAKT1
SCHEMBL332209 0.80 ALOX5 (0.61) 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 1305/4885PDE3B 136/4885

“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.