SCHEMBL4519973

SCHEMBL4519973

CC(C)(C)OC(=O)NNC(=O)c1cc(F)c(N2CC3C(C2)C3NC(=O)OC(C)(C)C)cc1NC1CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.36
KDM4D Q6B0I6 5/20 0.35
KAT8 Q9H7Z6 3/20 0.35
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
TNF P01375 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
KAT6A Q92794 1/20 0.33
KAT5 Q92993 1/20 0.33
PARP1 P09874 1/20 0.33
GAA P10253 1/20 0.33
F10 P00742 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
ROCK2 O75116 1/20 0.32

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
SCHEMBL4505737 0.87 TSHR (0.41) USP30ALDH1A1HTTGAAF10
SCHEMBL4515875 0.84 F10 (0.42) USP30KDM4DKAT8PARP1F10
SCHEMBL4526111 0.84 USP30 (0.33) USP30KDM4DKAT8ALDH1A1HTT
SCHEMBL4526115 0.84 USP30 (0.33) USP30KDM4DKAT8ALDH1A1HTT
SCHEMBL7512228 0.84 KDM4D (0.33) USP30KDM4DALDH1A1HTTTNF
SCHEMBL4501900 0.82 ROCK2 (0.43) KAT8IRAK4KAT6AKAT5GAA
SCHEMBL4508683 0.81 ACACB (0.42) TNFIRAK4F10DRD2
SCHEMBL4515547 0.81 KAT8 (0.38) KDM4DKAT8KAT6AKAT5DRD2
SCHEMBL4500116 0.81 PDE10A (0.35) KDM4DKAT8ALDH1A1HTTKAT6A
SCHEMBL4500109 0.81 PDE10A (0.35) KDM4DKAT8ALDH1A1HTTKAT6A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582627-B2 3-Amino-7-[3-(1-aminoethyl)-4-fluoropyrrolidin-1-yl]-1-cyclopropyl-8-methyl-1H-pyrido[4,3-d]pyrimidine-2,4-dione; quinolone antibiotics; bactericides; for antibiotic- resistant bacterial infections, ciprofloxacin- resistant ones; inhibiting wild-type and quinolone- resistant mutants of DNA gryase WARNER-LAMBERT COMPANY (US) 2009-09-01 US disclosed
EP-1255739-B1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2008-06-11 EP disclosed
US-20060287308-A1 3-Aminoquinazolin-2,4-dione antibacterial agents ZOETIS WLC LLC 2006-12-21 US disclosed
US-7094780-B1 3-aminoquinazolin-2,4-dione antibacterial agents WARNER LAMBERT COMPANY LLC (US) 2006-08-22 US disclosed
US-20060183762-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS ZOETIS WLC LLC 2006-08-17 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 (2 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-20060183762-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS ABL1, NQO2, CBR3 USP30 4162/4885KDM4D 1866/4885KAT8 74/4885
US-20060287308-A1 3-Aminoquinazolin-2,4-dione antibacterial agents ABL1, NQO2, AAAS USP30 4136/4885KDM4D 1744/4885KAT8 79/4885

“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.