SCHEMBL9892816

SCHEMBL9892816

O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@@H]1CCN1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.56
KMT2A Q03164 9/20 0.56
PSMD14 O00487 1/20 0.56
RAB9A P51151 5/20 0.56
NPC1 O15118 2/20 0.56
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 1/20 0.55
MPL P40238 1/20 0.52
ABL1 P00519 3/20 0.52
KDM4E B2RXH2 1/20 0.51
SIRT5 Q9NXA8 1/20 0.50

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
SCHEMBL13257020 0.93 ALDH1A1 (0.56) MEN1KMT2APSMD14RAB9ANPC1
SCHEMBL13257155 0.93 ALDH1A1 (0.56) MEN1KMT2APSMD14RAB9ANPC1
SCHEMBL9892895 0.82 LMNA (0.63) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL13257784 0.81 LMNA (0.61) MEN1KMT2ARAB9AMAPK1KDM4E
Hydrochloric Acid SCHEMBL31198045 0.80 MEN1 (0.58) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL16254980 0.79 ABL1 (0.79) MEN1KMT2APSMD14RAB9ANPC1
Hydrochloric Acid SCHEMBL31197976 0.79 RAB9A (0.53) MEN1KMT2ARAB9ANPC1ALDH1A1
Hydrochloric Acid SCHEMBL31198000 0.79 RAB9A (0.53) MEN1KMT2ARAB9ANPC1ALDH1A1
Hydrochloric Acid SCHEMBL31198023 0.79 RAB9A (0.53) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL13257017 0.78 LMNA (0.62) MEN1KMT2ARAB9ANPC1ALDH1A1

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 MEN1 4667/4885KMT2A 1863/4885PSMD14 3287/4885

“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.