SCHEMBL9892870

SCHEMBL9892870

CCc1nc(NC(=O)[C@@H]2CCN2)nn1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KHK P50053 4/20 0.46
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 1/20 0.39
JAK1 P23458 1/20 0.39
SLC5A1 P13866 5/20 0.38
JAK2 O60674 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
SCHEMBL13257170 0.93 KHK (0.49) KHKLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL9892292 0.84 LMNA (0.40) KHKLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL16254892 0.79 LMNA (0.68) LMNAKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL22060739 0.78 MAPK1 (0.51) KHKLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL22060311 0.78 MAPK1 (0.51) KHKLMNAKDM4EL3MBTL1ALDH1A1
SCHEMBL9892906 0.77 LMNA (0.51) LMNAKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL9891530 0.75 ALDH1A1 (0.52) LMNAKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL20458216 0.75 LMNA (0.49) LMNAKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL9892784 0.75 CNR2 (0.41) LMNAMAPK1JAK1JAK2
SCHEMBL22060736 0.73 MAPK1 (0.48) KHKLMNAKDM4EALDH1A1MAPK1

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 KHK 3746/4885LMNA 4544/4885KDM4E 1578/4885

“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.