SCHEMBL6500227

SCHEMBL6500227

Cc1c(NC(=O)OC(C)(C)C)ccc2nc(N(CC(=O)O)c3ccccc3)oc(=O)c12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 4/20 0.59
ELANE P08246 4/20 0.59
P2RX7 Q99572 1/20 0.36
BRD9 Q9H8M2 1/20 0.33
ACSS2 Q9NR19 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
BRD4 O60885 1/20 0.33
LCK P06239 2/20 0.32
CNR2 P34972 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
MAOB P27338 1/20 0.31
TDP2 O95551 1/20 0.31

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
SCHEMBL6401805 0.83 CTRB1 (0.60) CTRB1ELANEP2RX7BRD4HDAC6
SCHEMBL6400204 0.81 ELANE (0.65) CTRB1ELANEP2RX7LCKTDP2
SCHEMBL6401804 0.80 ELANE (0.54) CTRB1ELANEP2RX7LCK
SCHEMBL6401408 0.78 CTRB1 (0.54) CTRB1ELANEP2RX7MEN1KMT2A
SCHEMBL6402809 0.78 CTRB1 (0.51) CTRB1ELANEP2RX7LCKHDAC6
SCHEMBL6499873 0.77 CTRB1 (0.60) CTRB1ELANEP2RX7BRD9MEN1
SCHEMBL6500225 0.76 ELANE (0.58) CTRB1ELANEP2RX7BRD9MEN1
SCHEMBL6504081 0.75 ELANE (0.67) CTRB1ELANEP2RX7HDAC6
SCHEMBL6596758 0.75 ELANE (0.48) CTRB1ELANE
SCHEMBL6398072 0.75 CTRB1 (0.51) CTRB1ELANEMEN1NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5985872-A THERAPEUTIC TREATMENT OF HERPES VIRAL INFECTION G.D. SEARLE & CO. (US) 1999-11-16 US claimed
US-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. (US) 2005-02-10 US disclosed
US-6683077-B2 4H-3,1-BENZOXAZIN-4-ONE COMPOUNDS OF GIVEN FORMULA; HERPES INFECTIONS; ASSEMBLIN PROTEASE INHIBITORS G.D. SEARLE & CO. 2004-01-27 US disclosed
US-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. 2003-01-30 US disclosed
US-6380189-B1 FOR TREATING HERPES-RELATED DISORDERS G.D. SEARLE & CO. 2002-04-30 US disclosed
EP-0828721-B1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS SEARLE & CO (US) 2001-11-14 EP disclosed
EP-1122245-A2 2-Amino-benzoxazinones for the treatment of viral infections G.D. Searle & Co. (US) 2001-08-08 EP disclosed
US-5985872-A THERAPEUTIC TREATMENT OF HERPES VIRAL INFECTION G.D. SEARLE & CO. (US) 1999-11-16 US disclosed
EP-0828721-A1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS G.D. SEARLE & CO. (US) 1998-03-18 EP disclosed
WO-1996037485-A1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS G.D. SEARLE & CO. (US) 1996-11-28 WO 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-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, HAX1 CTRB1 2628/4885ELANE 2176/4885P2RX7 274/4885
US-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, ACE2 CTRB1 1716/4885ELANE 1199/4885P2RX7 148/4885

“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.