SCHEMBL5079585

SCHEMBL5079585

CSc1ccnc2c1c(Sc1ccc(F)cc1Cl)c1n2CCCC1CC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 20/20 0.79
PTGDR Q13258 20/20 0.79

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
SCHEMBL13122993 0.92 TBXA2R (0.80) TBXA2RPTGDR
SCHEMBL1040649 0.88 TBXA2R (1.00) TBXA2RPTGDR
SCHEMBL4466127 0.84 TBXA2R (0.79) TBXA2RPTGDR
SCHEMBL990588 0.84 TBXA2R (1.00) TBXA2RPTGDR
SCHEMBL18269302 0.80 TBXA2R (0.86) TBXA2RPTGDR
SCHEMBL13122992 0.80 PTGDR (0.80) TBXA2RPTGDR
SCHEMBL1255205 0.80 TBXA2R (1.00) TBXA2RPTGDR
SCHEMBL13638150 0.78 TBXA2R (0.62) TBXA2RPTGDR
SCHEMBL3148394 0.76 TBXA2R (0.73) TBXA2RPTGDR
SCHEMBL991147 0.74 PTGDR (1.00) TBXA2RPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080139604-A1 Method of Treating Atherosclerosis, Dyslipidemias and Related Conditions MERCK SHARP & DOHME CORP. 2008-06-12 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 (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-20080139604-A1 Method of Treating Atherosclerosis, Dyslipidemias and Related Conditions LDLR, HCAR1, FFAR1 TBXA2R 37/4885PTGDR 201/4885

“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.