SCHEMBL845150

SCHEMBL845150

CNS(=O)(=O)c1ccccc1-n1c(CO)nc2cc(C)c(C(=O)O)c(C)c2c1=O

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.64
CNR2 P34972 1/20 0.64
DHODH Q02127 5/20 0.35
PIK3CD O00329 6/20 0.35
DHFR P00374 1/20 0.35
ALKBH5 Q6P6C2 1/20 0.35
PDE10A Q9Y233 3/20 0.34
TSHR P16473 1/20 0.33
PDE4D Q08499 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 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
SCHEMBL844571 0.89 CNR1 (0.79) CNR1CNR2PIK3CDTSHRPDE4D
SCHEMBL844506 0.89 CNR1 (0.56) CNR1CNR2DHODHTSHRALDH1A1
SCHEMBL17694537 0.86 CNR1 (0.67) CNR1CNR2DHODHPIK3CDDHFR
SCHEMBL17692388 0.86 CNR1 (0.86) CNR1CNR2DHODHPIK3CDDHFR
SCHEMBL18673206 0.84 CNR1 (0.78) CNR1CNR2DHODHPIK3CDPDE10A
SCHEMBL844516 0.80 CNR1 (0.75) CNR1CNR2TSHRALDH1A1KMT2A
SCHEMBL844625 0.79 CNR1 (0.57) CNR1CNR2
SCHEMBL844174 0.78 CNR1 (0.87) CNR1CNR2PIK3CDTSHRPDE4D
SCHEMBL17694535 0.78 CNR1 (0.79) CNR1CNR2TSHRALDH1A1KMT2A
Sad448 SCHEMBL844484 0.78 CNR1 (1.00) CNR1CNR2PIK3CDTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552015-B2 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2013-10-08 US disclosed
EP-1472234-B1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS NOVARTIS AG (CH) 2012-03-28 EP disclosed
EP-2319839-A1 Quinazolinone derivatives and their use as CB agonists Novartis AG (CH) 2011-05-11 EP disclosed
US-20070265285-A1 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2007-11-15 US disclosed
US-20050085493-A1 Quinazolinone derivatives and their use as cb agonists BRAIN CHRISTOPHER T (GB) 2005-04-21 US disclosed
EP-1472234-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS Novartis AG (CH) 2004-11-03 EP disclosed
WO-2003066603-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS NOVARTIS AG (CH) 2003-08-14 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-20070265285-A1 Quinazolinone derivatives and their use as CB agonists CNR1, ADRB1, ADRA1D CNR1 1/4885CNR2 8/4885DHODH 1992/4885
US-20050085493-A1 Quinazolinone derivatives and their use as cb agonists CNR1, ADRB1, ADRA2B CNR1 1/4885CNR2 8/4885DHODH 2050/4885

“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.