SCHEMBL10107929

SCHEMBL10107929

CS(=O)(=O)c1ccc(Oc2ncnc(OC3C4COCC3CN(c3ncc(Cl)cn3)C4)c2F)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.50
CYP2C9 P11712 1/20 0.44
KCNH2 Q12809 1/20 0.43
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38

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
SCHEMBL10107047 0.91 GPR119 (0.51) GPR119CYP2C9KCNH2NR1H2NR1H3
SCHEMBL10107988 0.86 GPR119 (0.43) GPR119CYP2C9KCNH2NR1H2NR1H3
SCHEMBL10107002 0.85 GPR119 (0.54) GPR119
SCHEMBL10107745 0.82 GPR119 (0.54) GPR119
SCHEMBL10107852 0.82 GPR119 (0.56) GPR119
SCHEMBL10107879 0.81 GPR119 (0.42) GPR119KCNH2NR1H2NR1H3
SCHEMBL12170494 0.81 GPR119 (0.47) GPR119CYP2C9KCNH2NR1H2NR1H3
SCHEMBL12170476 0.81 GPR119 (0.47) GPR119CYP2C9KCNH2NR1H2NR1H3
SCHEMBL10107054 0.80 GPR119 (0.57) GPR119
SCHEMBL14870764 0.80 GPR119 (0.41) GPR119CYP2C9KCNH2NR1H2NR1H3

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-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME CORP. 2012-02-16 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-20120040975-A1 BRIDGED BICYCLIC HETEROCYCLE DERIVATIVES AND METHODS OF USE THEREOF GPR119, BDKRB2, GLP1R GPR119 1/4885CYP2C9 999/4885KCNH2 1403/4885

“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.