SCHEMBL6085183

SCHEMBL6085183

[CH]=C[C@H](O)[C@@H](C)CC#CC

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.31
PTGER1 P34995 1/20 0.30
PTGER3 P43115 1/20 0.30
PTGER2 P43116 1/20 0.30
PTGIR P43119 1/20 0.30
PTGDR Q13258 1/20 0.30

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
SCHEMBL6084123 1.00 PTGER4 (0.31) PTGER4PTGER1PTGER3PTGER2PTGIR
SCHEMBL6260120 1.00 PTGER4 (0.31) PTGER4PTGER1PTGER3PTGER2PTGIR
SCHEMBL16117443 0.80 PTGER4 (0.30) PTGER4PTGER1PTGER3PTGER2PTGIR
SCHEMBL9060859 0.80 PTGER4 (0.34) PTGER4PTGER3PTGER2
SCHEMBL18133251 0.78 PTGER4 (0.34) PTGER4PTGER1PTGER3PTGER2PTGIR
SCHEMBL28439876 0.75
SCHEMBL18943883 0.75 PTGER4 (0.33) PTGER4PTGER1PTGER3PTGER2PTGIR
SCHEMBL10613483 0.73
SCHEMBL5157582 0.70
SCHEMBL712718 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071359-B1 Neuropathy improvers containing nitrogenous compounds as the active ingredient TEIJIN LIMITED (JP) 2006-07-04 US disclosed
EP-1201235-B1 NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT TEIJIN LTD (JP) 2005-10-12 EP disclosed
EP-1201235-A1 NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT TEIJIN LIMITED (JP) 2002-05-02 EP disclosed