SCHEMBL844174

SCHEMBL844174

CCNC(=O)OCc1nc2cc(C)c(C(=O)OCC)c(C)c2c(=O)n1-c1ccccc1S(=O)(=O)NC

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.87
CNR2 P34972 1/20 0.87
KDM4E B2RXH2 2/20 0.35
THRB P10828 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PIK3CD O00329 4/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
TSHR P16473 1/20 0.32
CREBBP Q92793 1/20 0.31
ADORA1 P30542 1/20 0.31
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE1C Q14123 1/20 0.31
PDE3A Q14432 1/20 0.31

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
Hydrochloric Acid SCHEMBL844735 0.99 CNR1 (0.86) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL17692331 0.94 CNR1 (0.90) CNR1CNR2KDM4ETHRBKMT2A
Sad448 SCHEMBL844484 0.93 CNR1 (1.00) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL844571 0.89 CNR1 (0.79) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL10974453 0.89 CNR1 (0.69) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL844881 0.88 CNR1 (0.69) CNR1CNR2PIK3CDCREBBP
SCHEMBL844333 0.88 CNR1 (0.90) CNR1CNR2PIK3CDESR1ESR2
SCHEMBL844485 0.88 CNR1 (0.75) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL844516 0.88 CNR1 (0.75) CNR1CNR2KDM4ETHRBKMT2A
SCHEMBL17694535 0.87 CNR1 (0.79) CNR1CNR2KDM4ETHRBKMT2A

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 19 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 claimed
EP-1472234-B1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS NOVARTIS AG (CH) 2012-03-28 EP claimed
EP-2319839-A1 Quinazolinone derivatives and their use as CB agonists Novartis AG (CH) 2011-05-11 EP claimed
US-20080004296-A1 Organic Compounds CHARMAN CHRISTINE 2008-01-03 US claimed
US-20070265285-A1 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2007-11-15 US claimed
WO-2005123694-A2 QUINAZOLINONE COMPOUNDS FOR THE TREATMENT OF COUGH NOVARTIS AG (CH) 2005-12-29 WO claimed
WO-2005058326-A1 USE OF QUINAZOLINONE DERIVATIVES FOR THE INHIBITION OF TRANSIENT LOWER ESOPHAGEAL SPHINCTER RELAXATIONS (TLESRs) ASTRAZENECA AB (SE) 2005-06-30 WO claimed
US-20050085493-A1 Quinazolinone derivatives and their use as cb agonists BRAIN CHRISTOPHER T (GB) 2005-04-21 US claimed
EP-1472234-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS Novartis AG (CH) 2004-11-03 EP claimed
WO-2003066603-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS CB AGONISTS NOVARTIS AG (CH) 2003-08-14 WO claimed
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-20080004296-A1 Organic Compounds CHARMAN CHRISTINE 2008-01-03 US disclosed
US-20070265285-A1 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2007-11-15 US disclosed
WO-2005123694-A2 QUINAZOLINONE COMPOUNDS FOR THE TREATMENT OF COUGH NOVARTIS AG (CH) 2005-12-29 WO 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 (3 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 8/4885KDM4E 3258/4885
US-20080004296-A1 Organic Compounds OTC, OAT, CHRM1 CNR1 595/4885CNR2 1208/4885KDM4E 3309/4885
US-20050085493-A1 Quinazolinone derivatives and their use as cb agonists CNR1, ADRB1, ADRA2B CNR1 1/4885CNR2 8/4885KDM4E 3214/4885

“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.