SCHEMBL6981959

SCHEMBL6981959

OC(CCn1ccnc1)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.73
TBXAS1 P24557 2/20 0.57
HMOX2 P30519 1/20 0.52
QPCT Q16769 2/20 0.52
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50

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
SCHEMBL11758479 0.92 CYP19A1 (0.77) CYP19A1TBXAS1QPCT
SCHEMBL11637474 0.89 TBXAS1 (0.71) CYP19A1TBXAS1QPCT
SCHEMBL11636280 0.89 TBXAS1 (0.71) CYP19A1TBXAS1QPCT
SCHEMBL11363968 0.89 CYP19A1 (0.58) CYP19A1TBXAS1QPCTCYP11B1CYP11B2
SCHEMBL11386158 0.87 CYP19A1 (0.57) CYP19A1TBXAS1
SCHEMBL11147343 0.87 CYP19A1 (0.57) CYP19A1TBXAS1
SCHEMBL5303970 0.85 CYP19A1 (1.00) CYP19A1TBXAS1HMOX2QPCTCYP11B1
SCHEMBL11630824 0.84 CYP19A1 (0.53) CYP19A1CYP11B1CYP11B2
SCHEMBL11633201 0.84 CYP19A1 (0.73) CYP19A1QPCTCYP11B1CYP11B2
SCHEMBL11756428 0.84 CYP19A1 (0.53) CYP19A1QPCTCYP11B1CYP11B2

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
US-20030199530-A1 New compounds derived from quinazoline LES LABORATORIES SERVIER (FR) 2003-10-23 US disclosed
CN-1445226-A New cornpound derivated from quinazoline, itd preparation method and medicinal composite containig them ADIR (FR) 2003-10-01 CN disclosed
EP-1346992-A1 Quinazoline derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2003-09-24 EP disclosed
US-4518607-A FUNGICIDES, BACXTERICIDES AND ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1985-05-21 US disclosed
US-4078071-A FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1978-03-07 US disclosed
US-4045568-A FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1977-08-30 US 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 1823/4885TBXAS1 423/4885HMOX2 3336/4885

“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.