SCHEMBL5175166

SCHEMBL5175166

C[C@@H](Oc1ccc(Cl)cc1-c1ccc(C(=O)NC2CC2)c(F)c1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.46
PTGDR Q13258 1/20 0.46
TSHR P16473 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
HPGD P15428 2/20 0.41
NAAA Q02083 1/20 0.41
HMOX1 P09601 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GCG P01275 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ACVR1B P36896 1/20 0.40
TGFBR1 P36897 1/20 0.40
ACVRL1 P37023 1/20 0.40
MAPK14 Q16539 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL2100439 1.00 PTGDR2 (0.46) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2103458 0.97 PTGDR2 (0.50) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2101693 0.97 PTGDR2 (0.47) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2100243 0.87 TSHR (0.49) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2103013 0.87 TSHR (0.49) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2102473 0.84 GCG (0.48) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL2099811 0.84 TSHR (0.46) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2101408 0.84 LMNA (0.53) PTGDR2PTGDRTSHRHTR2AHTR2C
SCHEMBL2100572 0.84 ABCB11 (0.53) PTGDR2NAAAHRH3SMN1; SMN2NPSR1
SCHEMBL3340724 0.84 NAAA (0.51) TSHRHTR2AHTR2BHPGDNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784388-A1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE AstraZeneca AB (SE) 2007-05-16 EP claimed
WO-2006021759-A1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2006-03-02 WO claimed