SCHEMBL9014468

SCHEMBL9014468

CCCCC/C(=N/OC/C=C1/CCCc2c(OCC(=O)O)cccc21)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 9/20 0.45
PTGIR P43119 5/20 0.38
PTGDR Q13258 1/20 0.38
ALDH1A1 P00352 2/20 0.35
TBXA2R P21731 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL9014473 1.00 TBXAS1 (0.45) TBXAS1PTGIRPTGDRALDH1A1TBXA2R
SCHEMBL9014183 0.87 TBXAS1 (0.49) TBXAS1PTGIRPTGDRALDH1A1LMNA
SCHEMBL9014179 0.87 TBXAS1 (0.49) TBXAS1PTGIRPTGDRALDH1A1LMNA
SCHEMBL9014525 0.85 TBXAS1 (0.49) TBXAS1PTGIRPTGDRALDH1A1
SCHEMBL9014518 0.85 TBXAS1 (0.49) TBXAS1PTGIRPTGDRALDH1A1
SCHEMBL9014587 0.85 TBXAS1 (0.62) TBXAS1PTGIRPTGDRALDH1A1TBXA2R
SCHEMBL9014585 0.85 TBXAS1 (0.62) TBXAS1PTGIRPTGDRALDH1A1TBXA2R
SCHEMBL9014609 0.84 TBXAS1 (0.47) TBXAS1PTGIRPTGDRALDH1A1LMNA
SCHEMBL9014612 0.84 TBXAS1 (0.47) TBXAS1PTGIRPTGDRALDH1A1LMNA
SCHEMBL9014292 0.84 TBXAS1 (0.43) TBXAS1PTGIRALDH1A1TBXA2RLMNA

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
EP-0581187-B1 Oxime derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP disclosed
US-5480998-A Oxime derivative ONO PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 US disclosed
EP-0581187-A1 Oxime derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-02-02 EP disclosed