SCHEMBL5776535

SCHEMBL5776535

Fc1cc(Br)c2c(Sc3ccc(Cl)cc3)c3n(c2c1F)CC[CH]3

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 11/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.32

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
SCHEMBL5777302 0.87 TBXA2R (0.33) TBXA2RPTGDR2
SCHEMBL5773536 0.81 TBXA2R (0.56) TBXA2RPTGDR2
SCHEMBL5776538 0.79 TBXA2R (0.39) TBXA2RPTGDR2
SCHEMBL5777733 0.76 TBXA2R (0.42) TBXA2RPTGDR2
SCHEMBL5778258 0.72 TBXA2R (0.72) TBXA2RPTGDR2
SCHEMBL5778173 0.68 TBXA2R (0.50) TBXA2RPTGDR2
SCHEMBL5777307 0.66 TBXA2R (0.32) TBXA2RPTGDR2
SCHEMBL6732180 0.62 TBXA2R (0.64) TBXA2RPTGDR2
SCHEMBL5773541 0.61 TBXA2R (0.55) TBXA2RPTGDR2
SCHEMBL5778238 0.61 TBXA2R (0.72) TBXA2RPTGDR2

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
EP-1395590-B1 DIHYDROPYRROLO¬1,2-A|INDOLE AND TETRAHYDROPYRIDO¬1,2-A|INDOLE DERIVATIVES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS MERCK FROSST CANADA INC (CA) 2006-09-27 EP disclosed