SCHEMBL4457521

SCHEMBL4457521

O=C(O)N1CCC(COc2ncc(-c3cc(F)c(O)c(F)c3)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 4/20 0.41
FFAR4 Q5NUL3 8/20 0.40
JAK3 P52333 1/20 0.40
GRIN2B Q13224 1/20 0.38
ACHE P22303 1/20 0.38
GPR119 Q8TDV5 2/20 0.38
RBP4 P02753 1/20 0.37

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
SCHEMBL14191534 0.85 GPR119 (0.53) GPR119
SCHEMBL4455486 0.83 PARP10 (0.49) AOC3FFAR4GRIN2BACHEGPR119
SCHEMBL15189938 0.78 FFAR4 (0.41) FFAR4GPR119RBP4
SCHEMBL4455518 0.78 GRIN2B (0.46) AOC3JAK3GRIN2BACHEGPR119
SCHEMBL4460540 0.77 CHRM4 (0.45) AOC3GPR119
SCHEMBL20893509 0.77 GRIN2B (0.44) AOC3GRIN2BACHERBP4
SCHEMBL4456659 0.77 PARP15 (0.48) AOC3GRIN2BACHEGPR119
SCHEMBL4455478 0.76 GPR119 (0.46) AOC3GRIN2BACHEGPR119
SCHEMBL15189889 0.76 FFAR4 (0.39) FFAR4GPR119RBP4
SCHEMBL15190087 0.76 FFAR4 (0.38) FFAR4GPR119RBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP claimed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO claimed
EP-2059517-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS Biovitrum AB (publ) (SE) 2009-05-20 EP disclosed
US-20080103141-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025800-A1 PYRIMIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO 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-20080103141-A1 New compounds GPR119, GPR3, GPR4 AOC3 999/4885FFAR4 21/4885JAK3 2511/4885

“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.