SCHEMBL9048745

SCHEMBL9048745

O=C(CC1CCc2c(cccc2C(=O)C(=O)O)C1)NCC(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.44
PRMT5 O14744 3/20 0.40
WDR77 Q9BQA1 3/20 0.40
BCHE P06276 3/20 0.38
TBXAS1 P24557 1/20 0.36
TACR1 P25103 1/20 0.36

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
SCHEMBL9048134 0.86 PTGIR (0.45) PTGIR
SCHEMBL9046598 0.84 POLB (0.41) PTGIR
SCHEMBL9048858 0.83 PTGIR (0.46) PTGIRTBXAS1
SCHEMBL9046845 0.83 HPGD (0.47) PTGIRBCHE
SCHEMBL9048750 0.81 PTGIR (0.69) PTGIRTBXAS1
SCHEMBL9048747 0.81 PTGIR (0.51) PTGIRPRMT5WDR77TBXAS1
SCHEMBL9048366 0.78 PTGIR (0.43) PTGIR
SCHEMBL9045194 0.76 CHRM2 (0.41) PTGIRTBXAS1
SCHEMBL9049412 0.73 ALDH1A1 (0.39) PTGIR
SCHEMBL9046465 0.73 PRMT5 (0.41) PRMT5WDR77

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-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP claimed
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP claimed