SCHEMBL12320344

SCHEMBL12320344

Cc1c(Nc2ccc(C#N)cc2Cl)ncnc1OC1CC2CCC(C1)N2

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 17/20 0.69
SLC6A2 P23975 3/20 0.45
SLC6A3 Q01959 3/20 0.45
SLC6A4 P31645 2/20 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
SCHEMBL10106426 1.00 GPR119 (0.69) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL10120596 0.96 GPR119 (0.67) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL10121122 0.92 GPR119 (0.69) GPR119
SCHEMBL10120603 0.92 GPR119 (0.69) GPR119
SCHEMBL14668822 0.89 GPR119 (0.57) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL16281377 0.89 GPR119 (0.57) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL12320073 0.89 GPR119 (0.57) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL16281378 0.89 GPR119 (0.55) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL14668823 0.89 GPR119 (0.55) GPR119SLC6A2SLC6A3SLC6A4
SCHEMBL12320005 0.89 GPR119 (0.55) GPR119SLC6A2SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8907095-B2 Bicyclic heterocycle derivatives and their use as modulators of the activity of GPR119 MERCK SHARP & DOHME CORP. (US) 2014-12-09 US disclosed
US-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 SCHERING CORPORATION 2011-09-01 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-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 GPR119, GPR88, GPR180 GPR119 1/4885SLC6A2 2518/4885SLC6A3 2805/4885

“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.