SCHEMBL9014600

SCHEMBL9014600

O=C(O)COc1cccc2c1CCCC2CCONC(Cc1ccccc1)c1cccnc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.60
PTGIR P43119 10/20 0.57
KDM4C Q9H3R0 3/20 0.43
SIGMAR1 Q99720 2/20 0.38
HTR1A P08908 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37

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
SCHEMBL9014462 0.95 TBXAS1 (0.60) TBXAS1PTGIRKDM4CSIGMAR1HTR1A
SCHEMBL9014526 0.90 TBXAS1 (0.63) TBXAS1PTGIRKDM4CHTR1AADRA1D
SCHEMBL9014182 0.89 TBXAS1 (0.58) TBXAS1PTGIRKDM4C
SCHEMBL9014331 0.87 PTGIR (0.58) TBXAS1PTGIRKDM4CHTR1AADRA1D
SCHEMBL9014158 0.85 TBXAS1 (0.46) TBXAS1PTGIRKDM4C
SCHEMBL9014156 0.85 TBXAS1 (0.46) TBXAS1PTGIRKDM4C
SCHEMBL9014153 0.85 TBXAS1 (0.46) TBXAS1PTGIRKDM4C
SCHEMBL9014599 0.85 PTGIR (0.62) TBXAS1PTGIRKDM4CSIGMAR1HTR1A
SCHEMBL9014515 0.85 TBXAS1 (0.59) TBXAS1PTGIRKDM4C
SCHEMBL9014231 0.84 PTGIR (0.57) TBXAS1PTGIRSIGMAR1

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