SCHEMBL12241538

SCHEMBL12241538

CC(C)OC(=O)N1CCC(Oc2cc(Nc3ccc(S(=O)(=O)C4CC4)cc3F)ncn2)CC1

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.85
CYP2C9 P11712 6/20 0.52
KCNH2 Q12809 2/20 0.50

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
SCHEMBL288892 0.92 GPR119 (1.00) GPR119CYP2C9KCNH2
SCHEMBL12241537 0.89 GPR119 (0.67) GPR119CYP2C9
SCHEMBL386787 0.87 GPR119 (0.80) GPR119CYP2C9KCNH2
SCHEMBL391292 0.86 GPR119 (0.77) GPR119CYP2C9KCNH2
SCHEMBL12241539 0.86 GPR119 (0.85) GPR119CYP2C9KCNH2
SCHEMBL389552 0.84 GPR119 (0.75) GPR119CYP2C9KCNH2
SCHEMBL391183 0.84 GPR119 (0.75) GPR119CYP2C9KCNH2
SCHEMBL389816 0.84 GPR119 (0.75) GPR119CYP2C9KCNH2
SCHEMBL12241555 0.84 GPR119 (0.84) GPR119CYP2C9KCNH2
SCHEMBL12241594 0.84 GPR119 (0.85) GPR119CYP2C9KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382203-B1 BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME (US) 2015-01-14 EP disclosed
US-8410122-B2 Bicyclic heterocycle derivatives and methods of use thereof MERCK SHARP & DOHME CORP. (US) 2013-04-02 US disclosed
US-8410122-B2 Bicyclic heterocycle derivatives and methods of use thereof MERCK SHARP & DOHME CORP. (US) 2013-04-02 US disclosed
US-20110263624-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2011-10-27 US disclosed
US-20110263624-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2011-10-27 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-20110263624-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF GPR119, GCGR, BDKRB2 GPR119 1/4885CYP2C9 736/4885KCNH2 1803/4885

“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.