SCHEMBL6801066

SCHEMBL6801066

CCn1c(=O)n(OCc2ccccc2)c(=O)c2cc(F)c(N3CCCC3)nc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
CYP2C9 P11712 1/20 0.37
ATP6V1B2 P21281 1/20 0.37
TBXA2R P21731 1/20 0.37
EDNRA P25101 1/20 0.37
TARBP2 Q15633 1/20 0.37
TSHR P16473 4/20 0.37
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PDE5A O76074 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
ADORA1 P30542 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
PKM P14618 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL6799891 0.93 HRH4 (0.40) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL6797814 0.91 ALDH1A1 (0.38) LMNACYP2C9TSHRALDH1A1L3MBTL1
SCHEMBL6798888 0.91 MEN1 (0.38) LMNATSHRALDH1A1L3MBTL1TDP1
SCHEMBL6795761 0.85 PDE4A (0.36) LMNATSHRALDH1A1L3MBTL1NPSR1
SCHEMBL6801910 0.85 L3MBTL1 (0.37) CYP2C9TSHRALDH1A1L3MBTL1NPSR1
SCHEMBL6797293 0.83 L3MBTL1 (0.36) LMNATSHRALDH1A1L3MBTL1NPSR1
SCHEMBL6802921 0.83 ALDH1A1 (0.39) LMNACYP2C9TSHRALDH1A1L3MBTL1
SCHEMBL6796950 0.83 ALDH1A1 (0.40) CYP2C9TSHRALDH1A1L3MBTL1PDE5A
SCHEMBL6797050 0.82 ALDH1A1 (0.40) LMNACYP2C9TSHRALDH1A1TDP1
SCHEMBL6801139 0.81 GRM5 (0.39) LMNATSHRALDH1A1L3MBTL1HPGD

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 LMNA 3642/4885CYP2C9 974/4885ATP6V1B2 4012/4885

“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.