SCHEMBL4936899

SCHEMBL4936899

Cn1nc(C2=CCN(C(=O)OC(C)(C)C)CC2)ccc1=O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 11/20 0.55
GRM5 P41594 11/20 0.55
PDK4 Q16654 1/20 0.53
NAMPT P43490 1/20 0.47
WNT3A P56704 1/20 0.44
HTR6 P50406 1/20 0.44
JAK1 P23458 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
CNR1 P21554 1/20 0.42

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
SCHEMBL31053191 0.84 GRM1 (0.58) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL31053177 0.82 GRM1 (0.53) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL27025958 0.81 NAMPT (0.52) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL30308912 0.79 GRM1 (0.64) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL15553049 0.79 PDK4 (0.53) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL25480230 0.78 GRM1 (0.59) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL31639564 0.78 GRM1 (0.59) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL30439311 0.78 GRM1 (0.59) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL903903 0.78 GRM1 (0.56) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL15176153 0.78 GRM1 (0.59) GRM1GRM5PDK4NAMPTWNT3A

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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa ASTRAZENECA AB (SE) 2008-09-04 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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa F10, F12, F11 GRM1 2022/4885GRM5 2198/4885PDK4 4471/4885

“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.