SCHEMBL10106253

SCHEMBL10106253

[C-]#[N+]c1ccc(Nc2ncnc(OC3C4CCC3CNC4)c2F)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.44
EPHA2 P29317 1/20 0.34
KDR P35968 1/20 0.34
EPHB4 P54760 1/20 0.34
CYP2C9 P11712 1/20 0.32

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
SCHEMBL10106291 0.92 GPR119 (0.49) GPR119
SCHEMBL10106275 0.82 GPR119 (0.51) GPR119
SCHEMBL10106231 0.81 GPR119 (0.46) GPR119
SCHEMBL10106407 0.81 GPR119 (0.53) GPR119
SCHEMBL10106242 0.81 GPR119 (0.54) GPR119CYP2C9
SCHEMBL10106248 0.80 GPR119 (0.56) GPR119
SCHEMBL10106250 0.79 GPR119 (0.68) GPR119
SCHEMBL10106514 0.79 GPR119 (0.51) GPR119
SCHEMBL10106738 0.76 GPR119 (0.46) GPR119
SCHEMBL10106517 0.76 GPR119 (0.50) GPR119

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 1/4885EPHA2 1195/4885KDR 464/4885

“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.