SCHEMBL4938650

SCHEMBL4938650

CCc1cc(CC(=O)O)ccc1-c1ccc(OCc2ccc(C(F)(F)F)c(O)c2C=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 5/20 0.58
NR1H3 Q13133 5/20 0.58
RXRA P19793 6/20 0.44
FFAR1 O14842 7/20 0.41
FFAR4 Q5NUL3 7/20 0.41
RXRB P28702 3/20 0.41
RXRG P48443 3/20 0.41
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
NR1H4 Q96RI1 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 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
SCHEMBL4944371 0.89 NR1H2 (0.53) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL4942777 0.85 NR1H2 (0.53) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1678447 0.85 NR1H2 (0.81) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL4942716 0.84 NR1H2 (0.70) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1678766 0.84 AKR1C3 (0.50) NR1H2NR1H3RXRAFFAR1
SCHEMBL1678366 0.81 NR1H2 (0.54) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1679109 0.80 NR1H2 (0.76) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1678486 0.79 NR1H2 (0.81) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1679456 0.79 NR1H2 (0.77) NR1H2NR1H3RXRAFFAR1FFAR4
SCHEMBL1678454 0.78 NR1H2 (0.82) NR1H2NR1H3RXRAFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255111-A1 Tissue Factor Production Inhibitor SANKYO COMPANY LIMITED (JP) 2008-10-16 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
EP-1764075-A1 TISSUE FACTOR PRODUCTION INHIBITOR Sankyo Company, Limited (JP) 2007-03-21 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-20080255111-A1 Tissue Factor Production Inhibitor PTAFR, PLAT, TFPI NR1H2 7/4885NR1H3 6/4885RXRA 84/4885
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.