SCHEMBL1679569

SCHEMBL1679569

C=CCOC(=O)C(CN(C)C)c1ccc(-c2ccc(OCc3ccc(C(F)(F)F)c(O)c3C(=O)OC(C)(C)C)cc2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 11/20 0.53
NR1H3 Q13133 9/20 0.53
RXRA P19793 9/20 0.52
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
FFAR1 O14842 2/20 0.30
RET P07949 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
SCHEMBL1678347 0.89 NR1H2 (0.61) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1679682 0.81 NR1H2 (0.64) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678816 0.81 NR1H2 (0.53) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678814 0.81 NR1H2 (0.53) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678676 0.80 NR1H2 (0.66) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678336 0.76 NR1H2 (0.79) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678568 0.75 NR1H2 (0.50) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1678841 0.74 NR1H2 (0.46) NR1H2NR1H3RXRA
SCHEMBL1678149 0.74 NR1H2 (0.64) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1679286 0.73 NR1H2 (0.61) NR1H2NR1H3RXRAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923573-B2 Benzene compound having 2 or more substituents DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-04-12 US disclosed
US-20080004301-A1 Benzene Compound Having 2 or More Substituents DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-01-03 US disclosed
EP-1806332-A1 BENZENE COMPOUND HAVING 2 OR MORE SUBSTITUENTS Daiichi Sankyo Company, Limited (JP) 2007-07-11 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-20080004301-A1 Benzene Compound Having 2 or More Substituents NR1H2, NR1H3, NCOR2 NR1H2 1/4885NR1H3 2/4885RXRA 5/4885

“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.