SCHEMBL8022000

SCHEMBL8022000

COC(=O)C(=CO)Oc1cccc(C(C)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
ALDH1A1 P00352 2/20 0.49
RAB9A P51151 2/20 0.49
CYP1A2 P05177 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 1/20 0.45
MAOB P27338 7/20 0.44
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MAOA P21397 2/20 0.42

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
SCHEMBL8021996 1.00 NPC1 (0.49) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL8026284 0.90 NPC1 (0.54) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL8026280 0.87 NPC1 (0.48) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL8026283 0.87 NPC1 (0.48) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL9455956 0.79 EPHX1 (0.47)
SCHEMBL26802232 0.78 NPC1 (0.56) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL9455979 0.76 MTNR1A (0.43) NPC1ALDH1A1CYP1A2KMT2AMEN1
SCHEMBL30239922 0.76 LMNA (0.63) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL3141164 0.76 LMNA (0.63) NPC1ALDH1A1RAB9ACYP1A2SMN1; SMN2
SCHEMBL8024241 0.75 NOTUM (0.41) ALDH1A1RAB9AKMT2AMEN1L3MBTL1

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-0975587-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed
WO-1998043949-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-08 WO disclosed