SCHEMBL8902888

SCHEMBL8902888

COc1ccc(C(=O)O)c(C)c1O[Si](C)(C)C(C)(C)C.O=C1C2CC3CC(C2)CC1C3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
DRD2 P14416 1/20 0.33
MAPK1 P28482 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
CDC25B P30305 1/20 0.32
ALDH1A1 P00352 6/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 5/20 0.31
CNR2 P34972 1/20 0.31
HSD17B10 Q99714 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
HPGD P15428 2/20 0.30
MYC P01106 1/20 0.30

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
SCHEMBL2425023 0.69 MAPT (0.68) MAPTTDP1MAPK1SMN1; SMN2LMNA
SCHEMBL30466426 0.69 MAPT (0.68) MAPTTDP1MAPK1SMN1; SMN2LMNA
SCHEMBL12553219 0.67 MEN1 (0.38) MAPTTDP1DRD2SMN1; SMN2LMNA
SCHEMBL566279 0.66 KMT2A (0.46) MAPTTDP1LMNAALDH1A1MEN1
SCHEMBL732725 0.66 MAPT (0.61) MAPTTDP1MAPK1SMN1; SMN2LMNA
SCHEMBL2589446 0.65 TDP1 (0.43) MAPTTDP1MAPK1SMN1; SMN2ALDH1A1
SCHEMBL31019409 0.65 PTGER1 (0.42) TDP1MAPK1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9070650 0.65 PTGER1 (0.42) TDP1MAPK1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL8748732 0.64 KMT2A (0.52) MAPTTDP1KMT2A
SCHEMBL7598320 0.63 MAPK1 (0.49) MAPTTDP1MAPK1LMNAALDH1A1

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
US-5607625-A TEST KITS CONTAINING THE DIOXETANES ABBOTT LABORATORIES (US) 1997-03-04 US disclosed