SCHEMBL6506922

SCHEMBL6506922

CCN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)Nc1nc2c(Br)cc(N(C(=O)O)C(C)(C)C)c(C)c2c(=O)o1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.41
NPC1 O15118 1/20 0.34
CTRB1 P17538 3/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL6806041 0.91 ELANE (0.40) ELANECTRB1KMT2ARAB9AHPGD
SCHEMBL6507450 0.86 ELANE (0.47) ELANENPC1CTRB1
SCHEMBL7445829 0.84 ELANE (0.46) ELANENPC1CTRB1KMT2AALDH1A1
SCHEMBL6500582 0.83 ELANE (0.49) ELANECTRB1KMT2A
SCHEMBL6801336 0.83 ELANE (0.38) ELANENPC1LMNA
SCHEMBL6801293 0.81 ELANE (0.41) ELANENPC1KMT2AMEN1GAA
SCHEMBL6805263 0.81 ELANE (0.44) ELANECTRB1
SCHEMBL6805137 0.81 ELANE (0.39) ELANENPC1KMT2AMEN1RAB9A
SCHEMBL6801500 0.81 ELANE (0.42) ELANENPC1CTRB1KMT2AMEN1
SCHEMBL6497577 0.80 ELANE (0.40) ELANEKMT2ALMNA

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-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

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 ELANE 2176/4885NPC1 2233/4885CTRB1 2628/4885
US-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, ACE2 ELANE 1199/4885NPC1 2840/4885CTRB1 1716/4885

“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.