SCHEMBL3574382

SCHEMBL3574382

N#CC1(c2cccc(Sc3ccc(N(N)C(N)=O)cc3)c2)CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.46
CYP11B2 P19099 1/20 0.33
KMT2A Q03164 1/20 0.32
PIK3CD O00329 2/20 0.32
IDH1 O75874 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
SCHEMBL3572528 0.85 ALOX5 (0.41) ALOX5KMT2APIK3CD
SCHEMBL3567445 0.81 ALOX5 (0.43) ALOX5KMT2APIK3CD
SCHEMBL3561984 0.79 ALOX5 (0.43) ALOX5KMT2APIK3CD
SCHEMBL7892149 0.78 ALOX5 (0.42) ALOX5KMT2A
SCHEMBL7811821 0.73 ALOX5 (0.42) ALOX5KMT2APIK3CD
SCHEMBL1599579 0.72 ALOX5 (0.36) ALOX5KMT2APIK3CD
SCHEMBL1599433 0.72 ALOX5 (0.35) ALOX5PIK3CD
SCHEMBL7809060 0.72 KMT2A (0.41) ALOX5KMT2APIK3CD
SCHEMBL1599036 0.72 ALOX5 (0.38) ALOX5KMT2APIK3CD
SCHEMBL1599332 0.71 ALOX5 (0.39) ALOX5CYP11B2PIK3CD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7674811-B2 5-lipoxygenase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2010-03-09 US disclosed
US-20080021080-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-01-24 US 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-20080021080-A1 5-LIPOXYGENASE INHIBITORS ALOX5, ALOX15B, ALOX15 ALOX5 1/4885CYP11B2 410/4885KMT2A 4105/4885

“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.