SCHEMBL3275833

SCHEMBL3275833

COC(=O)Cn1cncc1C

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.43
CYP11B2 P19099 5/20 0.43
QPCT Q16769 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL28848247 0.83 CYP11B1 (0.48) CYP11B1CYP11B2QPCT
SCHEMBL3577086 0.81 ALDH1A1 (0.41) CYP11B1CYP11B2QPCTSMN1; SMN2
SCHEMBL13031367 0.79 LMNA (0.43) CYP11B1CYP11B2
SCHEMBL25311885 0.79 CYP11B1 (0.48) CYP11B1CYP11B2SMN1; SMN2
SCHEMBL4489945 0.79 CYP11B1 (0.48) CYP11B1CYP11B2SMN1; SMN2
SCHEMBL3978013 0.78 CYP11B1 (0.41) CYP11B1CYP11B2SMN1; SMN2
SCHEMBL1178676 0.78 CYP19A1 (0.39) CYP11B1CYP11B2QPCT
SCHEMBL17410493 0.76 RAB9A (0.52) CYP11B1CYP11B2QPCTSMN1; SMN2
SCHEMBL25854022 0.75 NPC1 (0.43) CYP11B1CYP11B2QPCTSMN1; SMN2
SCHEMBL13048283 0.75 CYP11B1 (0.47) CYP11B1CYP11B2QPCT

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 17 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
CN-100347169-C Quinazoline derivatives ASTRAZENECA AB (SE) 2007-11-07 CN disclosed
CN-100345844-C Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB (SE) 2007-10-31 CN disclosed
EP-1453492-B1 USE OF QUINAZOLINES TO TREAT T-CELL MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-01-24 EP disclosed
US-7160891-B2 Quinazoline derivatives for the treatment of T cell mediated diseases ASTRAZENECA AB (SE) 2007-01-09 US 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-20050038050-A1 Quinazoline derivatives for the treatment of t cell mediated diseases ASTRAZENECA AB (SE) 2005-02-17 US 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
US-20040034046-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2004-02-19 US disclosed
CN-1471527-A Quinazoline derivatives 2004-01-28 CN disclosed
CN-1434821-A Quinazoline derivatives for the treatment of tumours ASTRAZENECA AB (SE) 2003-08-06 CN 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 (6 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 CYP11B1 878/4885CYP11B2 478/4885QPCT 20/4885
US-20050014773-A1 Therapeutic use CD4, HLA-DRB1, CD74 CYP11B1 716/4885CYP11B2 712/4885QPCT 215/4885
US-20040214841-A1 Quinazoline derivatives for treatment of tumours NQO2, TOP1, TPD52L2 CYP11B1 1113/4885CYP11B2 678/4885QPCT 15/4885
US-20050038050-A1 Quinazoline derivatives for the treatment of t cell mediated diseases CD4, HLA-DRB1, IFNG CYP11B1 1210/4885CYP11B2 806/4885QPCT 53/4885
US-20100280042-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF TUMOURS TPD52L2, NQO2, H1-5 CYP11B1 878/4885CYP11B2 478/4885QPCT 20/4885
US-20040034046-A1 Quinazoline derivatives NQO2, NRAS, TOP1 CYP11B1 608/4885CYP11B2 300/4885QPCT 153/4885

“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.