SCHEMBL2285672

SCHEMBL2285672

Cc1ncc(C#CC2=CCN(C(=O)O)CC2)cn1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 18/20 0.42
OGA O60502 1/20 0.34
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL4048946 0.86 GRM5 (0.42) GRM5OGA
SCHEMBL4536276 0.83 GRM5 (0.40) GRM5OGA
SCHEMBL5090735 0.80 GRM5 (0.43) GRM5
SCHEMBL28811006 0.79 GRM5 (0.47) GRM5ALDH1A1SMN1; SMN2
SCHEMBL8675743 0.79 GRM5 (0.49) GRM5
SCHEMBL2290995 0.77 GRM5 (0.44) GRM5ALDH1A1SMN1; SMN2
SCHEMBL2892482 0.76 GRM5 (0.43) GRM5ALDH1A1SMN1; SMN2
SCHEMBL4053802 0.73 GRM5 (0.43) GRM5ALDH1A1SMN1; SMN2
SCHEMBL4047546 0.70 GRM5 (0.60) GRM5
SCHEMBL4538188 0.70 GRM5 (0.36) GRM5ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989620-B2 Hydantoin derivatives for the treatment of obstructive airway diseases ASTRAZENECA AB (SE) 2011-08-02 US disclosed
US-20100144771-A1 Novel Hydantoin Derivatives for the Treatment of Obstructive Airway Diseases ASTRAZENECA AB (SE) 2010-06-10 US disclosed
US-7648992-B2 Hydantoin derivatives for the treatment of obstructive airway diseases ASTRAZENECA AB (SE) 2010-01-19 US disclosed
EP-1778673-B1 NOVEL HYDANTOIN DERIVATIVES FOR THE TREATMENT OF OBSTRUCTIVE AIRWAY DISEASES ASTRAZENECA AB (SE) 2009-11-11 EP disclosed
CN-100543024-C The hydantoin derivatives that is used for the treatment of obstructive airway diseases ASTRAZENECA AB (SE) 2009-09-23 CN disclosed
US-20080064710-A1 Novel Hydantoin Derivatives for the Treatment of Obstructive Airway Diseases ASTRAZENECA AB (SE) 2008-03-13 US disclosed
CN-1980914-A Novel hydantoin derivatives for the treatment of obstructive airway diseases. ASTRAZENECA AB (SE) 2007-06-13 CN 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-20080064710-A1 Novel Hydantoin Derivatives for the Treatment of Obstructive Airway Diseases HRH4, HRH1, HRH2 GRM5 2437/4885OGA 3840/4885ALDH1A1 81/4885
US-20100144771-A1 Novel Hydantoin Derivatives for the Treatment of Obstructive Airway Diseases HRH4, HRH1, HRH2 GRM5 2364/4885OGA 3852/4885ALDH1A1 78/4885

“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.