SCHEMBL739241

SCHEMBL739241

Cn1nnc([C@@H](N(Cc2ccccc2)C(=O)O)C(C)(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 4/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
NPC1 O15118 1/20 0.37
ATM Q13315 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RIPK1 Q13546 2/20 0.35
TSHR P16473 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL531391 0.80 MEN1 (0.43) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL737475 0.78 NPSR1 (0.40) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL532131 0.77 MEN1 (0.36) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL736536 0.76 CYP1A2 (0.45) MEN1KMT2AATM
SCHEMBL739017 0.71 ATM (0.43) MEN1KMT2APOLBALDH1A1ATM
SCHEMBL5568803 0.69 ATM (0.48) ATMCNR1CNR2SMN1; SMN2
SCHEMBL15017515 0.68 DAGLA (0.48) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL13859223 0.68 MEN1 (0.51) MEN1KMT2APOLBALDH1A1NPC1
SCHEMBL11475616 0.67 MLYCD (0.44) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL737633 0.65 MEN1 (0.49) MEN1KMT2APOLBALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138177-B2 Benzimidazolone derivatives as CB2 receptor ligands PFIZER INC. (US) 2012-03-20 US disclosed
EP-1861377-B1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER (US) 2010-12-29 EP disclosed
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US disclosed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP disclosed
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS ANDO KAZUO 2009-07-16 US disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO disclosed
EP-1861377-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS Pfizer, Inc. (US) 2007-12-05 EP disclosed
WO-2006097808-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER JAPAN INC. (JP) 2006-09-21 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 (2 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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES TRPV1, CNR1, CNR2 MEN1 2819/4885KMT2A 4384/4885POLB 3106/4885
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS TRPV1, CNR1, CNR2 MEN1 3613/4885KMT2A 4607/4885POLB 3729/4885

“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.