SCHEMBL10120567

SCHEMBL10120567

CC(C)Oc1ncnc(Oc2ccc(C#N)cc2F)c1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.48
ICMT O60725 1/20 0.41
EIF4E P06730 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
DCK P27707 1/20 0.38
SLC22A12 Q96S37 1/20 0.37
TRPA1 O75762 8/20 0.36
SLC6A9 P48067 1/20 0.36
KCNH2 Q12809 1/20 0.36
MET P08581 1/20 0.35
EGLN2 Q96KS0 2/20 0.35

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
SCHEMBL10120512 0.88 AR (0.46) GPR119EIF4EMKNK1MKNK2DCK
SCHEMBL15381346 0.85 TRPA1 (0.44) GPR119ICMTDCKSLC22A12TRPA1
SCHEMBL10134278 0.82 GPR119 (0.48) GPR119ICMTDCKSLC22A12TRPA1
SCHEMBL10120569 0.79 EIF4E (0.51) GPR119EIF4EMKNK1MKNK2
SCHEMBL524718 0.79 SLC6A9 (0.45) GPR119ICMTEIF4EMKNK1MKNK2
SCHEMBL10105771 0.78 GPR119 (0.43) GPR119SLC22A12
SCHEMBL10105803 0.77 TRPA1 (0.36) GPR119TRPA1
SCHEMBL7029209 0.77 AR (0.48) GPR119ICMTSLC6A9KCNH2
SCHEMBL10105796 0.76 DCK (0.44) GPR119DCKSLC22A12
SCHEMBL10105798 0.76 GPR119 (0.51) GPR119SLC6A9

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 1/4885ICMT 4343/4885EIF4E 3412/4885

“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.