SCHEMBL2392492

SCHEMBL2392492

CCOC(=O)c1c[nH]c2c(c1=O)CCCC2

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
MAPT P10636 3/20 0.60
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
GABRA1 P14867 3/20 0.50
GABRB2 P47870 3/20 0.50
CLEC4M Q9H2X3 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
GABRB1 P18505 2/20 0.46
GABRA3 P34903 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 1/20 0.42
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL2394139 0.97 KDM4E (0.57) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL22289985 0.90 MAPT (0.54) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL394742 0.81 KDM4E (0.49) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL2395215 0.81 KDM4E (0.55) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL6305765 0.80 MAPT (0.48) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL14988458 0.79 MAPT (0.56) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL1544639 0.79 LMNA (0.48) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL4903460 0.77 BRD4 (0.50) KDM4EMAPTCYP1A2CYP3A4CYP2C19
SCHEMBL2114253 0.77 KDM4E (0.45) KDM4EMAPTCYP1A2KMT2AMEN1
SCHEMBL14499343 0.74 LMNA (0.56) KDM4EMAPTGABRA1GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2483275-B1 HETEROCYCLIC-FUSED PYRAZOLO[4,3-c]PYRIDIN-3-ONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2014-10-15 EP disclosed
EP-2252299-B1 FUSED PYRIDONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2014-03-19 EP disclosed
US-8426438-B2 Heterocyclic-fused pyrazolo[4,3-c]pyridin-3-one M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2013-04-23 US disclosed
US-20120178760-A1 Heterocyclic-Fused Pyrazolo[4,3-c] Pyridin-3-One M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME LLC 2012-07-12 US disclosed
US-8022215-B2 Fused pyridone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2011-09-20 US disclosed
US-8022215-B2 Fused pyridone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2011-09-20 US disclosed
US-20100324088-A1 Fused Pyridone M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME CORP. (US) 2010-12-23 US disclosed
US-20100324088-A1 Fused Pyridone M1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME CORP. (US) 2010-12-23 US disclosed
EP-2252299-A1 FUSED PYRIDONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS Merck Sharp & Dohme Corp. (US) 2010-11-24 EP disclosed
WO-2009102588-A1 FUSED PYRIDONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK & CO., INC. (US) 2009-08-20 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-20100324088-A1 Fused Pyridone M1 Receptor Positive Allosteric Modulators CHRM1, CHRM2, CHRM4 KDM4E 1574/4885MAPT 521/4885CYP1A2 303/4885
US-20120178760-A1 Heterocyclic-Fused Pyrazolo[4,3-c] Pyridin-3-One M1 Receptor Positive Allosteric Modulators CHRM1, CHRM4, CHRM2 KDM4E 1642/4885MAPT 449/4885CYP1A2 382/4885

“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.