SCHEMBL1665472

SCHEMBL1665472

O=c1c2cn(Cc3ccc(-n4cccn4)cc3)c3ncccc3c-2nn1-c1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.54
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
USP1 O94782 8/20 0.40
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
TP53 P04637 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
SCHEMBL10314673 0.90 CHRM1 (0.57) CHRM1USP1
SCHEMBL11895623 0.88 CHRM1 (0.70) CHRM1CNR1CNR2
SCHEMBL11895310 0.88 CHRM1 (0.56) CHRM1KDM4ELMNASMN1; SMN2CNR2
SCHEMBL1666095 0.86 CHRM1 (0.54) CHRM1KDM4ELMNASMN1; SMN2USP1
SCHEMBL10277336 0.83 CHRM1 (0.58) CHRM1KDM4ELMNASMN1; SMN2USP1
SCHEMBL1666184 0.83 CHRM1 (0.58) CHRM1KDM4ELMNASMN1; SMN2USP1
SCHEMBL11894871 0.82 CHRM1 (0.49) CHRM1KDM4ELMNASMN1; SMN2USP1
SCHEMBL6900579 0.82 CHRM1 (0.39) CHRM1KDM4ECNR1CNR2TP53
SCHEMBL6898796 0.81 CHRM1 (0.48) CHRM1KDM4ELMNASMN1; SMN2USP1
SCHEMBL10277233 0.80 CHRM1 (0.47) CHRM1KDM4ELMNASMN1; SMN2USP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
WO-2011041143-A1 HETEROCYCLIC-FUSED PYRAZOLO[4,3-c]PYRIDIN-3-ONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2011-04-07 WO claimed
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
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-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-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
EP-2483275-A1 HETEROCYCLIC-FUSED PYRAZOLO[4,3-c]PYRIDIN-3-ONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS Schering Corporation (US) 2012-08-08 EP 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-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-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
WO-2011041143-A1 HETEROCYCLIC-FUSED PYRAZOLO[4,3-c]PYRIDIN-3-ONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. (US) 2011-04-07 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 (1 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-20120178760-A1 Heterocyclic-Fused Pyrazolo[4,3-c] Pyridin-3-One M1 Receptor Positive Allosteric Modulators CHRM1, CHRM4, CHRM2 CHRM1 1/4885KDM4E 1642/4885LMNA 4032/4885

“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.