SCHEMBL8557635

SCHEMBL8557635

CCOC(=O)N1CCN(c2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.73
GAA P10253 5/20 0.73
LMNA P02545 4/20 0.73
KDM4E B2RXH2 1/20 0.73
ALDH1A1 P00352 7/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
HTT P42858 2/20 0.62
MAPK1 P28482 2/20 0.62
HPGD P15428 2/20 0.62
TSHR P16473 2/20 0.62
NPSR1 Q6W5P4 2/20 0.62
CASP1 P29466 1/20 0.62
KMT2A Q03164 4/20 0.56
MEN1 O00255 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
USP2 O75604 1/20 0.53
ENPP2 Q13822 1/20 0.52
NPC1 O15118 1/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL8703730 0.88 MAPT (0.73) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL1482126 0.88 MAPT (0.73) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL27456657 0.87 MAPT (0.71) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL4118503 0.87 MAPT (0.71) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL3067260 0.86 ALDH1A1 (0.58) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL2943696 0.86 MAPT (0.55) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL2951888 0.86 MAPT (0.55) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL27610366 0.86 MAPT (0.74) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL15127501 0.86 MAPT (0.79) MAPTGAALMNAKDM4EALDH1A1
SCHEMBL4116463 0.85 MAPT (0.69) MAPTGAALMNAKDM4EALDH1A1

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-5795893-A Fibrinogen receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1998-08-18 US disclosed