SCHEMBL7697059

SCHEMBL7697059

CCOC(=O)CNC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.56
CHRNA4 P43681 3/20 0.56
CHRNB4 P30926 2/20 0.56
CHRNA3 P32297 2/20 0.56
PPID Q08752 1/20 0.52
ALDH1A1 P00352 4/20 0.51
LMNA P02545 2/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KDM4E B2RXH2 1/20 0.50
CASP1 P29466 1/20 0.49
HTT P42858 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
HPGD P15428 1/20 0.48
PDCD1 Q15116 1/20 0.47
CD274 Q9NZQ7 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL8947154 0.87 CHRNB2 (0.60) CHRNB2CHRNA4CHRNB4CHRNA3LMNA
SCHEMBL7703200 0.86 PPID (0.50) CHRNB2CHRNA4CHRNB4CHRNA3PPID
SCHEMBL27375291 0.86 CHRNB2 (0.54) CHRNB2CHRNA4CHRNB4CHRNA3LMNA
SCHEMBL28261473 0.81 LMNA (0.58) CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1
SCHEMBL1222232 0.81 ALDH1A1 (0.58) PPIDALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL1649572 0.80 CHRNB2 (0.68) CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1
SCHEMBL7217604 0.80 CHRNB2 (0.68) CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1
SCHEMBL11007801 0.80 CHRNB2 (0.72) CHRNB2CHRNA4CHRNB4CHRNA3ALDH1A1
SCHEMBL11161449 0.79 HPGD (0.57) PPIDALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL71818 0.79 RAB9A (0.66) PPIDALDH1A1LMNAMAPTSMN1; SMN2

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed