SCHEMBL6912150

SCHEMBL6912150

COC(=O)c1cc(Cc2ccc(Cl)nc2)c2ccccc2c1N

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 9/20 0.49
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
KCNH2 Q12809 1/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ADCY10 Q96PN6 1/20 0.38
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37

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
SCHEMBL12065096 0.88 CHRM1 (0.50) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL19128406 0.87 KMT2A (0.43) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL9978637 0.87 CHRM1 (0.49) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL16937247 0.87 CHRM1 (0.61) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL19128179 0.86 CHRM1 (0.50) CHRM1KCNH2ALDH1A1
SCHEMBL1437099 0.85 ABL1 (0.46) CHRM1KMT2AKDM4EMAPTALDH1A1
SCHEMBL2337391 0.80 ALDH1A1 (0.45) KMT2AKDM4EMAPTALDH1A1GAA
SCHEMBL6911869 0.80 CHRM1 (0.44) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL9931087 0.80 CHRM1 (0.44) CHRM1KMT2AKDM4ELMNAMAPK1
SCHEMBL14740140 0.79 CHRM1 (0.49) CHRM1KMT2AKDM4EKCNH2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2915812-A1 Pyranyl aryl methyl benzoquinazolinone M1 receptor positive allosteric modulators Merck Sharp & Dohme Corp. (US) 2015-09-09 EP disclosed
EP-2473048-B1 PYRANYL ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2015-03-25 EP disclosed
US-20140364395-A1 Pyranyl Aryl Methyl Benzoquinolinone M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME (US) 2014-12-11 US disclosed
US-20140364395-A1 Pyranyl Aryl Methyl Benzoquinolinone M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME (US) 2014-12-11 US disclosed
US-8846702-B2 Pyranyl aryl methyl benzoquinazolinone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2014-09-30 US disclosed
US-8846702-B2 Pyranyl aryl methyl benzoquinazolinone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2014-09-30 US disclosed
US-20120157438-A1 PYRANYL ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP (US) 2012-06-21 US disclosed
US-20120157438-A1 PYRANYL ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP (US) 2012-06-21 US disclosed
WO-2011025851-A1 PYRANYL ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2011-03-03 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-20120157438-A1 PYRANYL ARYL METHYL BENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS CHRM1, CHRM2, OPRL1 CHRM1 1/4885KMT2A 1146/4885KDM4E 841/4885
US-20140364395-A1 Pyranyl Aryl Methyl Benzoquinolinone M1 Receptor Positive Allosteric Modulators CHRM1, OPRL1, CHRM2 CHRM1 1/4885KMT2A 997/4885KDM4E 921/4885

“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.