SCHEMBL3565528

SCHEMBL3565528

N#CC1(c2cccc(Sc3ccc(-n4ncn(CC5CCCCC5)c4=O)cc3)c2)CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.36
GRM2 Q14416 1/20 0.33
PIK3CD O00329 2/20 0.33
ROCK2 O75116 2/20 0.33
CYP19A1 P11511 3/20 0.32
TRPV4 Q9HBA0 1/20 0.30
AADAT Q8N5Z0 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL3579160 0.96 ALOX5 (0.38) ALOX5GRM2PIK3CDROCK2CYP19A1
SCHEMBL3579278 0.86 ALOX5 (0.40) ALOX5PIK3CDROCK2CYP19A1
SCHEMBL3570620 0.86 ALOX5 (0.37) ALOX5PIK3CDROCK2CYP19A1
SCHEMBL3564904 0.86 ALOX5 (0.37) ALOX5PIK3CDCYP19A1TRPV4
SCHEMBL3572433 0.86 ALOX5 (0.37) ALOX5PIK3CDCYP19A1TRPV4
SCHEMBL3576895 0.85 ALOX5 (0.54) ALOX5PIK3CDROCK2PDE4APDE4B
SCHEMBL3569185 0.85 ALOX5 (0.38) ALOX5PIK3CDCYP19A1TRPV4AADAT
SCHEMBL3568013 0.85 ALOX5 (0.39) ALOX5PIK3CDROCK2CYP19A1
SCHEMBL3562712 0.85 ALOX5 (0.39) ALOX5PIK3CDROCK2CYP19A1
SCHEMBL3571105 0.85 ALOX5 (0.38) ALOX5PIK3CDROCK2CYP19A1

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 6 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 claimed
US-20080021080-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-01-24 US claimed
EP-1834953-A1 Tetrahydropyrane derivatives as 5-lipoxygenase inhibitors Ranbaxy Laboratories Limited (IN) 2007-09-19 EP claimed
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
EP-1834953-A1 Tetrahydropyrane derivatives as 5-lipoxygenase inhibitors Ranbaxy Laboratories Limited (IN) 2007-09-19 EP 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 1/4885GRM2 3546/4885PIK3CD 2405/4885

“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.