SCHEMBL8569157

SCHEMBL8569157

CC(=O)N1CCc2cc(CCO)ccc21

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.61
LMNA P02545 6/20 0.56
POLB P06746 2/20 0.54
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
RECQL P46063 1/20 0.52
MAPT P10636 3/20 0.50
TP53 P04637 1/20 0.50

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
SCHEMBL13020232 0.88 NOTUM (0.61) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL3782121 0.87 NOTUM (0.62) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL3783835 0.87 NOTUM (0.60) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL8803744 0.86 NOTUM (0.58) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL14090157 0.85 NOTUM (0.65) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL9088878 0.84 NOTUM (0.66) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL29150848 0.84 NOTUM (0.63) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL10716438 0.82 NOTUM (0.61) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL3789114 0.80 NOTUM (0.52) NOTUMLMNAPOLBKDM4EALDH1A1
SCHEMBL8570134 0.80 NOTUM (0.56) NOTUMLMNAPOLBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431943-B1 Spiro(pyran)piperidine derivatives MERCK & CO INC (US) 1998-07-15 EP disclosed
US-5633247-A ANTIARRTHYMIA AGENT MERCK & CO., INC. (US) 1997-05-27 US disclosed
CN-1110685-A Nitrogen-containing spiro ring MERCK & CO INC (US) 1995-10-25 CN disclosed
US-5206240-A Antiarrhythmia agents MERCK & CO., INC. (US) 1993-04-27 US disclosed
CN-1053613-A Nitrogen-containing spiro ring MERCK & CO INC (US) 1991-08-07 CN disclosed
EP-0431943-A2 Nitrogen-containing spirocycles MERCK & CO. INC. (US) 1991-06-12 EP disclosed