SCHEMBL9693206

SCHEMBL9693206

CC(C)COC(=O)c1ccc(OCC(O)CSc2nc3ccccc3[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.52
RAB9A P51151 5/20 0.52
MAPT P10636 6/20 0.48
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 4/20 0.45
LMNA P02545 4/20 0.45
AR P10275 3/20 0.45
MEN1 O00255 2/20 0.45
HTT P42858 2/20 0.45
HPGD P15428 2/20 0.45
NPC1 O15118 3/20 0.45
POLB P06746 2/20 0.45
GALR3 O60755 2/20 0.44
STAT3 P40763 1/20 0.44
TP53 P04637 1/20 0.43
RECQL P46063 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
GCGR P47871 1/20 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
SCHEMBL9123290 0.89 SMN1; SMN2 (0.53) SMN1; SMN2RAB9AMAPTKDM4EKMT2A
SCHEMBL12576912 0.82 AR (0.65) SMN1; SMN2RAB9AMAPTKMT2ALMNA
SCHEMBL9222642 0.82 PTGES (0.47) SMN1; SMN2MAPTKDM4EKMT2ALMNA
SCHEMBL9124267 0.79 MAPT (0.50) SMN1; SMN2RAB9AMAPTKMT2ALMNA
SCHEMBL9125655 0.79 APEX1 (0.51) SMN1; SMN2RAB9AMAPTKDM4EKMT2A
SCHEMBL9693018 0.79 RAB9A (0.62) SMN1; SMN2RAB9AMAPTKDM4EKMT2A
SCHEMBL9124612 0.78 MAPT (0.51) SMN1; SMN2RAB9AMAPTKDM4EKMT2A
SCHEMBL9693067 0.77 TSHR (0.41) SMN1; SMN2RAB9AMAPTKDM4EKMT2A
SCHEMBL9692997 0.77 EGFR (0.50) KMT2ALMNAMEN1HTTALDH1A1
SCHEMBL14864569 0.76 SMN1; SMN2 (0.46) SMN1; SMN2RAB9AMAPTKMT2ALMNA

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
EP-0520552-A1 Derivatives of (hetero) aromatic ethers and thioethers having antihyperlipidemic activity, process for their preparation and pharmaceutical compositions containing them PIERREL S.p.A. (IT) 1992-12-30 EP claimed