SCHEMBL3274878

SCHEMBL3274878

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.75
HPGD P15428 1/20 0.60
PREP P48147 1/20 0.51
UCHL1 P09936 2/20 0.51
HRH2 P25021 1/20 0.51
HRH1 P35367 1/20 0.51

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
SCHEMBL6979623 1.00 HSD17B10 (0.75) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL18461898 0.98 HSD17B10 (0.77) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL5219163 0.98 HSD17B10 (0.77) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL3280014 0.98 HSD17B10 (0.77) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL5429775 0.95 HSD17B10 (0.72) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL5429769 0.95 HSD17B10 (0.72) HSD17B10HPGDPREPUCHL1HRH2
SCHEMBL13779912 0.88 HSD17B10 (0.71) HSD17B10HPGDUCHL1HRH2HRH1
SCHEMBL6973694 0.88 HSD17B10 (0.71) HSD17B10HPGDUCHL1HRH2HRH1
SCHEMBL15014501 0.88 HSD17B10 (0.76) HSD17B10HPGDUCHL1HRH2HRH1
SCHEMBL7116177 0.88 HSD17B10 (0.76) HSD17B10HPGDUCHL1HRH2HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100280042-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS HENNEQUIN LAURENT FRANCOIS ANDRE 2010-11-04 US disclosed
US-7696214-B2 Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB (SE) 2010-04-13 US disclosed
EP-1453492-B1 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-01-24 EP disclosed
US-7157467-B2 Administering compound such as 6-methoxy-4-(2,3-methylenedioxyanilino)-7-(3-morpholinopropoxy)quinazoline for therapy of an autoimmune disease or medical condition selected from transplant rejection and rheumatoid arthritis ASTRAZENECA AB (SE) 2007-01-02 US disclosed
US-20060258642-A1 Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB 2006-11-16 US disclosed
US-7115615-B2 Quinazoline derivatives ASTRAZENECA (SE) 2006-10-03 US disclosed
US-7049438-B2 Quinazoline derivatives for treatment of tumours ASTRAZENECA AB (SE) 2006-05-23 US disclosed
EP-1450808-B1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF T CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2005-06-15 EP disclosed
US-20050014773-A1 Therapeutic use ASTRAZENACA AB (SE) 2005-01-20 US disclosed
US-20040214841-A1 Quinazoline derivatives for treatment of tumours ASTRAZENECA AB (SE) 2004-10-28 US disclosed
WO-2001094341-A9 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2003-04-17 WO disclosed
EP-1292594-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS AstraZeneca AB (SE) 2003-03-19 EP disclosed
WO-2001094341-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS ASTRAZENECA AB (SE) 2001-12-13 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 (4 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-20060258642-A1 Quinazoline derivatives for the treatment of tumours TPD52L2, NQO2, H1-5 HSD17B10 4548/4885HPGD 581/4885PREP 931/4885
US-20050014773-A1 Therapeutic use CD4, HLA-DRB1, CD74 HSD17B10 4036/4885HPGD 1735/4885PREP 2166/4885
US-20040214841-A1 Quinazoline derivatives for treatment of tumours NQO2, TOP1, TPD52L2 HSD17B10 4763/4885HPGD 759/4885PREP 1424/4885
US-20100280042-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS TPD52L2, NQO2, H1-5 HSD17B10 4548/4885HPGD 581/4885PREP 931/4885

“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.