SCHEMBL8867607

SCHEMBL8867607

CCOC(=O)N1CCC(O)(C#CC(C)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 2/20 0.41
ALDH1A1 P00352 5/20 0.41
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
GAA P10253 4/20 0.39
RECQL P46063 1/20 0.39
CYP2D6 P10635 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
ABL1 P00519 1/20 0.36
MAPT P10636 1/20 0.36
RIN1 Q13671 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.36
ATM Q13315 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
SCHEMBL8866898 0.83 L3MBTL1 (0.41) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL31282949 0.81 TSHR (0.44) L3MBTL1TSHRALDH1A1SMN1; SMN2HTT
SCHEMBL6208321 0.77 L3MBTL1 (0.40) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL6824028 0.76 ALDH1A1 (0.50) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL24606816 0.76 TSHR (0.50) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL5986980 0.72 TSHR (0.53) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL895343 0.72 L3MBTL1 (0.55) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL3956031 0.70 JAK2 (0.37) L3MBTL1TSHRCYP2D6CYP1A2CYP2C9
SCHEMBL16644572 0.70 GAA (0.47) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2
SCHEMBL21138360 0.70 TSHR (0.55) L3MBTL1TSHRALDH1A1POLBSMN1; SMN2

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
US-5594000-A THAT STIMULATE CENTRAL MUSCARINIC ACETYLCHOLINE RECEPTORS, ANALGESICS, NERVOUS SYSTEM DISORDERS, MENTAL ILLNESS ASTRA AB (SE) 1997-01-14 US disclosed
WO-1994000456-A1 SPIROFURANE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISORDERS FISONS CORPORATION (US) 1994-01-06 WO disclosed
EP-0490901-A1 NOVEL SPIROFURANE DERIVATIVES Astra Aktiebolag (SE) 1992-06-24 EP disclosed
EP-0491562-A1 Novel spirofurane derivatives FISONS CORPORATION (US) 1992-06-24 EP disclosed
US-5075317-A 2,8-dimethyl-1-oxa-8-azospiro(4.5) decan-3-one; alzheimer*s di sease FISONS CORPORATION (US) 1991-12-24 US disclosed
WO-1990015804-A1 NOVEL SPIROFURANE DERIVATIVES FISONS CORPORATION (US) 1990-12-27 WO disclosed