SCHEMBL7564657

SCHEMBL7564657

CCCCOC(=O)N1CCCCC1c1cc(O)c(NC(=O)OCc2ccccc2)cn1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.45
TMEM97 Q5BJF2 5/20 0.44
SIGMAR1 Q99720 5/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PRCP P42785 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ELANE P08246 1/20 0.39
FKBP1A P62942 1/20 0.39
F10 P00742 1/20 0.38
AADAT Q8N5Z0 1/20 0.38

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
SCHEMBL5730247 0.88 GFER (0.45) GFERTMEM97SIGMAR1ALDH1A1TSHR
SCHEMBL7492933 0.80 TMEM97 (0.45) GFERTMEM97SIGMAR1ALDH1A1TSHR
SCHEMBL29540420 0.72 TMEM97 (0.56) TMEM97SIGMAR1L3MBTL1FKBP1A
SCHEMBL22721972 0.72 TMEM97 (0.56) TMEM97SIGMAR1L3MBTL1FKBP1A
SCHEMBL22338396 0.72 FKBP1A (0.64) KDM4ELMNAPRCPFKBP1A
SCHEMBL23485251 0.69 FKBP1A (0.60) KDM4ELMNAPRCPFKBP1A
SCHEMBL28829596 0.69 CYP3A4 (0.52) TMEM97SIGMAR1FKBP1AAADAT
SCHEMBL29760850 0.69 CYP3A4 (0.52) TMEM97SIGMAR1FKBP1AAADAT
SCHEMBL27901742 0.68 TSHR (0.53) TMEM97SIGMAR1ALDH1A1TSHRL3MBTL1
SCHEMBL29097370 0.67 TMEM97 (0.55) TMEM97SIGMAR1FKBP1AAADAT

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-1246810-A1 PIPERIDINYLOXY AND PYRROLIDINYLOXYPHENYL OXAZOLIDINONES AS ANTIBACTERIALS Ortho-McNeil Pharmaceutical, Inc. (US) 2002-10-09 EP disclosed
WO-2001046164-A1 PIPERIDINYLOXY AND PYRROLIDINYLOXYPHENYL OXAZOLIDINONES AS ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-06-28 WO disclosed