SCHEMBL6899210

SCHEMBL6899210

Cc1ccccc1-n1nc2c3nccnc3n(Cc3ccc(-n4cccn4)cc3)cc-2c1=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 6/20 0.51
USP1 O94782 11/20 0.41
FSCN1 Q16658 1/20 0.38
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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 0.89 CHRM1 (0.57) CHRM1USP1FSCN1
SCHEMBL11955177 0.84 CHRM1 (0.73) CHRM1
SCHEMBL6911395 0.83 CHRM1 (0.58) CHRM1USP1KDM4ELMNASMN1; SMN2
SCHEMBL11895576 0.81 CHRM1 (0.49) CHRM1USP1FSCN1KDM4ELMNA
SCHEMBL6899264 0.81 CHRM1 (0.54) CHRM1USP1KDM4ELMNASMN1; SMN2
SCHEMBL11895057 0.80 CHRM1 (0.55) CHRM1USP1KDM4ELMNASMN1; SMN2
SCHEMBL18222119 0.80 CHRM1 (0.55) CHRM1USP1
SCHEMBL6912041 0.80 CHRM1 (0.55) CHRM1USP1
SCHEMBL11895263 0.80 CHRM1 (0.49) CHRM1USP1KDM4ELMNASMN1; SMN2
SCHEMBL6911995 0.79 CHRM1 (0.54) CHRM1USP1

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
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
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-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
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 1/4885USP1 3417/4885FSCN1 4818/4885

“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.