SCHEMBL3023627

SCHEMBL3023627

CN([C]=O)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
RECQL P46063 1/20 0.48
EPHX1 P07099 1/20 0.48
GPR119 Q8TDV5 10/20 0.46
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
USP30 Q70CQ3 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44

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
SCHEMBL4719540 0.92 USP30 (0.53) HPGDRECQLEPHX1GPR119USP30
SCHEMBL13089780 0.86 GPR119 (0.51) HPGDRECQLEPHX1GPR119USP2
SCHEMBL4711418 0.83 HPGD (0.55) HPGDRECQLEPHX1GPR119USP2
SCHEMBL19633473 0.82 HPGD (0.54) HPGDRECQLEPHX1GPR119USP2
SCHEMBL771727 0.82 EPHX1 (0.38) EPHX1GPR119USP2SMN1; SMN2KMT2A
SCHEMBL883794 0.81 HPGD (0.53) HPGDRECQLEPHX1GPR119USP2
SCHEMBL19717593 0.81 HPGD (0.56) HPGDRECQLEPHX1GPR119USP2
SCHEMBL19311891 0.81 HPGD (0.53) HPGDRECQLEPHX1GPR119USP2
SCHEMBL696090 0.79 HPGD (0.62) HPGDRECQLEPHX1GPR119USP2
SCHEMBL1827484 0.79 HPGD (0.51) HPGDRECQLEPHX1GPR119USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216791-A1 PYRIDINYLQUINAZOLINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA (SE) 2010-08-26 US claimed
WO-2008020203-A1 PYRIDINYLQUINAZ0LINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2008-02-21 WO claimed
US-20100216791-A1 PYRIDINYLQUINAZOLINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA (SE) 2010-08-26 US disclosed
WO-2008020203-A1 PYRIDINYLQUINAZ0LINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2008-02-21 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-20100216791-A1 PYRIDINYLQUINAZOLINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS BRAF, RAF1, ARAF HPGD 1183/4885RECQL 173/4885EPHX1 1768/4885

“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.