SCHEMBL3709150

SCHEMBL3709150

C[Si](C)(C)C#Cc1cc(Cl)ccc1OCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.67
CYP2C9 P11712 1/20 0.63

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
SCHEMBL12145499 0.85 PTGDR2 (0.72) PTGDR2CYP2C9
SCHEMBL12145814 0.84 PTGDR2 (0.48) PTGDR2CYP2C9
SCHEMBL3716615 0.82 PTGDR2 (0.63) PTGDR2CYP2C9
SCHEMBL17040987 0.81 HPGD (0.43) PTGDR2CYP2C9
SCHEMBL1371316 0.81 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL1369463 0.80 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL1368495 0.80 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL1368456 0.79 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL1371655 0.79 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL4595546 0.79 PTGDR2 (0.68) PTGDR2CYP2C9

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-2396295-A1 PHENOXY ACETIC ACID DERIVATIVES Merck Serono S.A. (CH) 2011-12-21 EP disclosed
WO-2010092043-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2010-08-19 WO disclosed