SCHEMBL6978774

SCHEMBL6978774

N#Cc1ccc(CC(CO)Cn2ccnc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.59
CYP11B1 P15538 4/20 0.59
CYP11B2 P19099 3/20 0.59
TBXAS1 P24557 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
CACNA1B Q00975 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
SCHEMBL6971161 0.82 CYP11B1 (0.56) CYP19A1CYP11B1CYP11B2
SCHEMBL6969784 0.82 QPCT (0.54) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL6979413 0.78 CYP19A1 (0.55) CYP19A1CYP11B1CYP11B2TBXAS1L3MBTL1
SCHEMBL10926330 0.76 CYP19A1 (0.59) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL771716 0.75 CYP11B1 (1.00) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL11279766 0.75 CYP19A1 (0.67) CYP19A1CYP11B1CYP11B2TBXAS1
SCHEMBL11083222 0.75 CYP19A1 (0.61) CYP19A1CYP11B1CYP11B2TBXAS1L3MBTL1
Hydrochloric Acid SCHEMBL8307735 0.74 CYP11B1 (0.97) CYP19A1CYP11B1CYP11B2TBXAS1
Hydrochloric Acid SCHEMBL11082698 0.74 CYP19A1 (0.59) CYP19A1CYP11B1CYP11B2TBXAS1L3MBTL1
SCHEMBL11703283 0.73 CYP19A1 (0.63) CYP19A1CYP11B1CYP11B2TBXAS1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030199530-A1 New compounds derived from quinazoline LES LABORATORIES SERVIER (FR) 2003-10-23 US disclosed
EP-1346992-A1 Quinazoline derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2003-09-24 EP 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-20030199530-A1 New compounds derived from quinazoline NQO2, XDH, DRD1 CYP19A1 1823/4885CYP11B1 162/4885CYP11B2 128/4885

“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.