SCHEMBL9568003

SCHEMBL9568003

O=C(NOC(c1ccccc1)c1ccccc1)C1CCCc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
HTT P42858 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
KCNQ2 O43526 1/20 0.44
PSMB5 P28074 2/20 0.43
CRBN Q96SW2 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
IDO1 P14902 2/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP2D6 P10635 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL9046164 0.80 PTGIR (0.37) PRMT5WDR77
SCHEMBL9568009 0.80 LMNA (0.56) PRMT5WDR77HTTTRPM8KCNQ2
SCHEMBL9567986 0.79 UGCG (0.50) PRMT5WDR77HTTTRPM8ALDH1A1
SCHEMBL9567989 0.79 PRMT5 (0.60) PRMT5WDR77HTTTRPM8KCNQ2
SCHEMBL9046170 0.79 PTGIR (0.44)
SCHEMBL9046175 0.78 PTGIR (0.60)
SCHEMBL31297148 0.78 CRBN (0.49) PRMT5WDR77HTTKCNQ2CRBN
SCHEMBL4220276 0.78 CRBN (0.49) PRMT5WDR77HTTKCNQ2CRBN
SCHEMBL9568047 0.77 TRPV1 (0.44) ALDH1A1
SCHEMBL9568169 0.76 PRMT5 (0.52) PRMT5WDR77HTTPSMB5ALDH1A1

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