SCHEMBL9892825

SCHEMBL9892825

O=C(Nc1nc(C2CCCCC2)cs1)[C@@H]1CCN1C1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.50
CNR1 P21554 5/20 0.50
ADORA1 P30542 3/20 0.44
TMIGD3 P0DMS9 2/20 0.44
RORC P51449 1/20 0.42
GCK P35557 1/20 0.40
ADORA2A P29274 1/20 0.40
RAB9A P51151 1/20 0.39
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TYR P14679 1/20 0.38

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
SCHEMBL13256832 0.95 CNR2 (0.54) CNR2CNR1ADORA1TMIGD3RORC
SCHEMBL9892852 0.80 CNR2 (0.58) CNR2CNR1RAB9AUSP2ALDH1A1
SCHEMBL13257046 0.79 CNR2 (0.55) CNR2CNR1ADORA1TMIGD3RORC
SCHEMBL9892794 0.79 CNR2 (0.62) CNR2CNR1GCKRAB9AALDH1A1
SCHEMBL13256841 0.77 SMN1; SMN2 (0.63) CNR2CNR1RAB9AUSP2ALDH1A1
SCHEMBL9892823 0.76 RAB9A (0.54) CNR2CNR1RAB9AALDH1A1LMNA
SCHEMBL9892093 0.75 CNR2 (0.72) CNR2CNR1GCKRAB9A
SCHEMBL9893021 0.75 CNR2 (0.52) CNR2CNR1ADORA1TMIGD3RORC
SCHEMBL9891987 0.75 CNR2 (0.52) CNR2CNR1ADORA1TMIGD3RORC
SCHEMBL16238286 0.74 CNR2 (0.40) CNR2CNR1RAB9AALDH1A1MAPT

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 CNR2 1/4885CNR1 2/4885ADORA1 106/4885

“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.