SCHEMBL12170477

SCHEMBL12170477

CC1(OC(=O)N2CC3COCC(C2)C3Oc2ncnc3c2ccn3-c2ccc(S(C)(=O)=O)cc2F)CC1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.54
CYP2C9 P11712 1/20 0.45
KCNH2 Q12809 1/20 0.45

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
SCHEMBL12170426 0.90 GPR119 (0.66) GPR119
SCHEMBL12170472 0.90 GPR119 (0.56) GPR119CYP2C9KCNH2
SCHEMBL12414061 0.89 GPR119 (0.57) GPR119CYP2C9KCNH2
SCHEMBL12170419 0.87 GPR119 (0.66) GPR119
SCHEMBL12170454 0.85 GPR119 (0.59) GPR119
SCHEMBL12170455 0.83 GPR119 (0.69) GPR119
SCHEMBL12170573 0.83 GPR119 (0.45) GPR119CYP2C9KCNH2
SCHEMBL12170481 0.83 GPR119 (0.44) GPR119CYP2C9KCNH2
SCHEMBL12170461 0.82 GPR119 (0.54) GPR119
SCHEMBL10108044 0.82 GPR119 (0.75) GPR119CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232073-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME CORPORATION 2012-09-13 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-20120232073-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF GPR119, GCGR, GPR4 GPR119 1/4885CYP2C9 1892/4885KCNH2 2973/4885

“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.