SCHEMBL5938643

SCHEMBL5938643

CC(C)(C)OC(=O)N1C[C@@H]2CC(=O)[C@@H]2C1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.54
LIPE Q05469 2/20 0.46
RORC P51449 1/20 0.44
USP30 Q70CQ3 1/20 0.44
PDE4B Q07343 1/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR119 Q8TDV5 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
NAMPT P43490 1/20 0.39
HPGD P15428 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL5940329 1.00 NR1H2 (0.54) NR1H2LIPERORCUSP30PDE4B
SCHEMBL43653 0.86 NR1H2 (0.50) NR1H2LIPERORCUSP30PDE4B
SCHEMBL5938227 0.86 NR1H2 (0.50) NR1H2LIPERORCUSP30PDE4B
SCHEMBL43652 0.86 NR1H2 (0.50) NR1H2LIPERORCUSP30PDE4B
SCHEMBL22784207 0.86 NR1H2 (0.50) NR1H2LIPERORCUSP30PDE4B
SCHEMBL5937935 0.86 GPR119 (0.50) LIPEUSP30GPR119KDM4EMAPT
SCHEMBL29560774 0.86 NR1H2 (0.50) NR1H2LIPERORCUSP30PDE4B
SCHEMBL5938285 0.86 GPR119 (0.47) NR1H2LIPEUSP30GPR119KDM4E
SCHEMBL14239659 0.83 NR1H2 (0.48) NR1H2LIPERORCUSP30PDE4B
SCHEMBL1692080 0.83 NR1H2 (0.48) NR1H2LIPERORCUSP30PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060287290-A1 Azabicyclic compounds are central nervous system active agents DART MICHAEL J 2006-12-21 US disclosed
US-7135484-B2 Azabicyclic compounds are central nervous system active agents ABBOTT LABORATORIES (US) 2006-11-14 US disclosed
US-20040152724-A1 Azabicyclic compounds are central nervous system active agents ABBVIE INC. 2004-08-05 US disclosed
US-20040044029-A1 Azabicyclic compounds are central nervous system active agents ABBOTT LABORATORIES 2004-03-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040152724-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHRNA6, CHRNA2 NR1H2 1050/4885LIPE 4594/4885RORC 1410/4885
US-20040044029-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHRNA6, CHRNA2 NR1H2 1050/4885LIPE 4594/4885RORC 1410/4885
US-20060287290-A1 Azabicyclic compounds are central nervous system active agents ACHE, CHAT, CHRNA6 NR1H2 570/4885LIPE 4379/4885RORC 658/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.