SCHEMBL9427232

SCHEMBL9427232

NC(=O)C(CC(c1ccccc1)c1ccccc1)C1CCc2c(cccc2C(=O)C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 9/20 0.36
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
TRPM8 Q7Z2W7 3/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9048118 0.90 PTGIR (0.36) PTGIRDRD2DRD3TRPM8KMT2A
SCHEMBL9427435 0.80 PTGIR (0.33) PTGIRDRD2DRD3TRPM8
SCHEMBL9427236 0.80 PTGIR (0.43) PTGIRDRD2DRD3
SCHEMBL9427242 0.80 PTGIR (0.59) PTGIR
SCHEMBL9048929 0.77 TDP1 (0.36) PTGIRTRPM8KMT2AALDH1A1TDP1
SCHEMBL9046598 0.74 POLB (0.41) PTGIRKMT2A
SCHEMBL9048217 0.73 TRPM8 (0.34) PTGIRTRPM8
SCHEMBL9048134 0.72 PTGIR (0.45) PTGIRKMT2AALDH1A1MEN1
SCHEMBL9048745 0.72 PTGIR (0.44) PTGIR
SCHEMBL9046845 0.72 HPGD (0.47) PTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5344836-A Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US claimed