SCHEMBL6797355

SCHEMBL6797355

COc1ccc(-n2c(=O)n(OCc3ccccc3)c(=O)c3cc(F)c(Cl)nc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
CYP3A4 P08684 4/20 0.39
CYP2C9 P11712 4/20 0.39
CYP2C19 P33261 4/20 0.39
CYP1A2 P05177 3/20 0.39
TSHR P16473 3/20 0.39
USP2 O75604 2/20 0.39
CYP2D6 P10635 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A2 O94788 1/20 0.39
ALDH1A3 P47895 1/20 0.39
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL6801352 0.90 ALDH1A1 (0.39) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6798905 0.90 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6799493 0.87 PPARD (0.35) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6797050 0.85 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6795249 0.84 PDE4A (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6797229 0.82 TP53 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6800611 0.81 CTSK (0.40) CYP1A2TSHRRXFP1LMNAMAPT
SCHEMBL6797211 0.81 GLA (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6796950 0.80 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL6801045 0.80 MAPT (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825199-B2 7-Substituted quinazolin-2,4-diones useful as antibacterial agents WARNER-LAMBERT COMPANY 2004-11-30 US claimed
EP-1028950-B1 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2003-05-02 EP claimed
US-20020115674-A1 Novel 7-substituted quinazolin-2,4-diones useful as antibacterial agents DOMAGALA JOHN MICHAEL (US) 2002-08-22 US claimed
US-6825199-B2 7-Substituted quinazolin-2,4-diones useful as antibacterial agents WARNER-LAMBERT COMPANY 2004-11-30 US disclosed
EP-1028950-B1 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2003-05-02 EP disclosed
US-20020115674-A1 Novel 7-substituted quinazolin-2,4-diones useful as antibacterial agents DOMAGALA JOHN MICHAEL (US) 2002-08-22 US disclosed
US-6331538-B1 TREATMENT OF BACTERIAL INFECTION WARNER-LAMBERT COMPANY 2001-12-18 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-20020115674-A1 Novel 7-substituted quinazolin-2,4-diones useful as antibacterial agents NQO2, TOP1, TOP2A ALDH1A1 3064/4885CYP3A4 185/4885CYP2C9 974/4885

“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.