SCHEMBL3427328

SCHEMBL3427328

O=C(O)[C@@H]1CCN1CC1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.47
HSD11B1 P28845 1/20 0.47
CNR2 P34972 6/20 0.41
CNR1 P21554 4/20 0.41
GRM2 Q14416 1/20 0.38
FEN1 P39748 1/20 0.36
ACE P12821 1/20 0.35
KDM4E B2RXH2 2/20 0.34
TSHR P16473 1/20 0.34
TACR2 P21452 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL3427330 1.00 GBA1 (0.47) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL2569369 0.90 HSD11B1 (0.58) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL2569370 0.90 HSD11B1 (0.58) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL3710748 0.88 HSD11B1 (0.53) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL3710751 0.88 HSD11B1 (0.53) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL3713499 0.87 HSD11B1 (0.52) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL3713502 0.87 HSD11B1 (0.52) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL13015330 0.84 GBA1 (0.46) GBA1HSD11B1CNR2CNR1KDM4E
SCHEMBL9105684 0.80 HSD11B1 (0.49) GBA1HSD11B1CNR2CNR1GRM2
SCHEMBL9105680 0.80 HSD11B1 (0.49) GBA1HSD11B1CNR2CNR1GRM2

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
EP-2443107-B1 AZETIDINE 2 -CARBOXAMIDE DERIVATIVES WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2018-08-08 EP disclosed
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
WO-2010147791-A1 AZETIDINE 2 -CARBOXAMIDE DERIVATIVES WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-23 WO 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 3407/4885CNR2 1/4885

“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.