SCHEMBL14701673

SCHEMBL14701673

O=Cc1cn(C2CCOCC2)cn1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.36
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
KDM2B Q8NHM5 1/20 0.30

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
SCHEMBL14701672 0.84 CDK5 (0.40) HCAR1GSK3BCDK5CDK5R1KDM2B
SCHEMBL15236765 0.82 CPB2 (0.40) HCAR1GSK3BCDK5CDK5R1
SCHEMBL3273845 0.82 CPB2 (0.40) HCAR1GSK3BCDK5CDK5R1
SCHEMBL14631015 0.79 CPB2 (0.42) CDK5CDK5R1KDM2B
SCHEMBL14631017 0.79 CPB2 (0.42) CDK5CDK5R1KDM2B
SCHEMBL12333257 0.79 CPB2 (0.43) HCAR1GSK3BCDK5CDK5R1KDM2B
SCHEMBL14631062 0.79 CPB2 (0.43) HCAR1GSK3BCDK5CDK5R1KDM2B
SCHEMBL14631484 0.79 CPB2 (0.42) CDK5CDK5R1KDM2B
SCHEMBL14789447 0.76 CDK5 (0.36) GSK3BDYRK1ACDK5CDK5R1KDM2B
SCHEMBL14631151 0.76 CPB2 (0.40) CDK5CDK5R1KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284350-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2016-03-15 US disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 US 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-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 HCAR1 2810/4885GSK3B 1919/4885DYRK1A 4481/4885

“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.