SCHEMBL6891992

SCHEMBL6891992

CCOC(=O)N1CC=CNC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
POLB P06746 2/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 5/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38
RECQL P46063 1/20 0.38
KDM4E B2RXH2 3/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36

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
Hydrochloric Acid SCHEMBL6647135 0.80 CHRNB2 (0.38) MAPTTSHRALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL31503973 0.78 TSHR (0.50) MAPTPOLBABL1RIN1TDP1
SCHEMBL6528859 0.77 GPR119 (0.33) TSHRALDH1A1SMN1; SMN2
SCHEMBL7394679 0.70 DPP4 (0.49) MAPTPOLBABL1RIN1TDP1
SCHEMBL11119249 0.70 MAPT (0.40) MAPTPOLBABL1RIN1TDP1
SCHEMBL4283831 0.70
SCHEMBL3663838 0.68 GAA (0.46) MAPTPOLBABL1RIN1TDP1
SCHEMBL17192597 0.68 TSHR (0.41) MAPTPOLBABL1RIN1TDP1
SCHEMBL30305936 0.68 TSHR (0.44) MAPTPOLBABL1RIN1TDP1
SCHEMBL30305960 0.68 TSHR (0.41) MAPTPOLBABL1RIN1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0907625-A4 FLUOROUS REACTION AND SEPARATION SYSTEMS UNIV PITTSBURGH (US) 2004-10-20 EP disclosed
EP-0907625-A1 FLUOROUS REACTION AND SEPARATION SYSTEMS UNIVERSITY OF PITTSBURGH (US) 1999-04-14 EP disclosed
WO-1998000376-A1 FLUOROUS REACTION AND SEPARATION SYSTEMS UNIVERSITY OF PITTSBURGH (US) 1998-01-08 WO disclosed