SCHEMBL12367673

SCHEMBL12367673

CC(C)(CO)NC(=O)C1CCN(CCOc2ccc(O)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.55
CACNA1G O43497 1/20 0.47
ACACB O00763 1/20 0.47
KDM4E B2RXH2 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
KCNH2 Q12809 1/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46

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
SCHEMBL5591529 0.79 LTA4H (0.72) LTA4HKDM4EHRH3KCNH2ESR1
SCHEMBL1008785 0.78 LTA4H (0.56) LTA4HKCNH2
SCHEMBL1892378 0.76 KCNH2 (0.73) LTA4HHRH3KCNH2
SCHEMBL1554865 0.76 LTA4H (0.56) LTA4HKDM4E
SCHEMBL4692595 0.73 LTA4H (0.69) LTA4HHRH3ESR1ESR2
SCHEMBL4689783 0.73 ESR1 (0.58) LTA4HHRH3KCNH2ESR1ESR2
SCHEMBL14117446 0.73 LTA4H (0.63) LTA4HKDM4EHRH3KCNH2
SCHEMBL12642580 0.73 LTA4H (0.52) LTA4HKDM4EESR1ESR2
SCHEMBL20423457 0.72 DRD3 (0.55)
SCHEMBL7135163 0.72 LTA4H (0.81) LTA4HCACNA1GKDM4E

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-8357684-B2 Thyazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-01-22 US disclosed
US-20110190503-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICAL NV 2011-08-04 US disclosed
US-20110159563-A1 Thyazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICAL NV 2011-06-30 US disclosed
EP-2336125-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase Janssen Pharmaceutica N.V. (BE) 2011-06-22 EP disclosed
US-7939527-B2 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2011-05-10 US disclosed
US-20090258854-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2009-10-15 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 (3 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-20090258854-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R2 LTA4H 1/4885CACNA1G 3384/4885ACACB 513/4885
US-20110159563-A1 Thyazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R2 LTA4H 1/4885CACNA1G 2757/4885ACACB 836/4885
US-20110190503-A1 Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R2 LTA4H 1/4885CACNA1G 3384/4885ACACB 513/4885

“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.