SCHEMBL9892853

SCHEMBL9892853

CCC1CCN1CC1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.46
HSD11B1 P28845 1/20 0.34
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
KDM4E B2RXH2 2/20 0.31
KCNH2 Q12809 1/20 0.31
EBP Q15125 1/20 0.31
NR1H2 P55055 1/20 0.30
PDE8B O95263 1/20 0.30

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
SCHEMBL9893057 0.89 HSD11B1 (0.41) GBA1HSD11B1CNR1CNR2KDM4E
SCHEMBL27126557 0.87 GBA1 (0.40) GBA1HSD11B1CNR1CNR2KDM4E
SCHEMBL25681716 0.82 GBA1 (0.30) GBA1
SCHEMBL9893161 0.79 HSD11B1 (0.34) GBA1HSD11B1CNR1CNR2KCNH2
SCHEMBL8513384 0.76 PDK1 (0.36) GBA1
SCHEMBL9893048 0.74 GBA1 (0.41) GBA1HSD11B1CNR2
SCHEMBL9892987 0.74 GBA1 (0.41) GBA1HSD11B1CNR2
SCHEMBL12717512 0.74 MAPK1 (0.36) CNR1CNR2KDM4E
SCHEMBL16480436 0.74 MAPK1 (0.36) CNR1CNR2KDM4E
SCHEMBL9891495 0.72 GBA1 (0.45) GBA1HSD11B1CNR1CNR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383615-B2 Azetidine 2-carboxamide derivatives which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-02-26 US disclosed
US-20120142666-A1 Azetidine 2-Carboxamide Derivatives Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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 (1 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-20120142666-A1 Azetidine 2-Carboxamide Derivatives Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 GBA1 1744/4885HSD11B1 3407/4885CNR1 2/4885

“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.