SCHEMBL2850008

SCHEMBL2850008

CCCOC1CN(c2cccc(C(=O)O)c2)CCC1NC(=O)c1nc(Cl)c(CC)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.40
PPARD Q03181 7/20 0.39
PPARG P37231 2/20 0.39
TOP2A P11388 2/20 0.39

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
SCHEMBL2850011 1.00 PPARA (0.40) PPARAPPARDPPARGTOP2A
SCHEMBL2854956 0.94 PPARA (0.40) PPARAPPARDPPARGTOP2A
SCHEMBL2854958 0.94 PPARA (0.40) PPARAPPARDPPARGTOP2A
SCHEMBL2850897 0.93 TOP2A (0.38) TOP2A
SCHEMBL2850902 0.93 TOP2A (0.38) TOP2A
SCHEMBL2847952 0.92 ABCC2 (0.41) PPARA
SCHEMBL2847947 0.92 ABCC2 (0.41) PPARA
SCHEMBL2848270 0.88 TOP2A (0.39) PPARATOP2A
SCHEMBL2848267 0.88 TOP2A (0.39) PPARATOP2A
SCHEMBL2852022 0.86 TOP2A (0.40) TOP2A

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
EP-2226322-B1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO CO LTD (JP) 2015-01-21 EP disclosed
US-8927588-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-06 US disclosed
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-03-13 US disclosed
US-8536197-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-17 US disclosed
US-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-12-09 US disclosed
EP-2226322-A1 IMIDAZOLE CARBONYL COMPOUND Daiichi Sankyo Company, Limited (JP) 2010-09-08 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 (2 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-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A PPARA 2960/4885PPARD 2681/4885PPARG 2052/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A PPARA 3514/4885PPARD 2901/4885PPARG 2748/4885

“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.