SCHEMBL6806153

SCHEMBL6806153

Cc1c(CN(Cc2ccccc2)C(=O)O)cc(Br)c2nc(N[C@@H](Cc3ccccc3)C(=O)N(C)CCc3ccccc3)oc(=O)c12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.39
CTRB1 P17538 1/20 0.34
LPAR1 Q92633 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TACR1 P25103 3/20 0.33
HCRTR1 O43613 1/20 0.33
LIPE Q05469 1/20 0.33
ADAM17 P78536 2/20 0.32
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ADORA2A P29274 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 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
SCHEMBL6800996 0.94 ELANE (0.41) ELANECTRB1TACR1HCRTR1RAB9A
SCHEMBL6507241 0.89 ELANE (0.40) ELANECTRB1TACR1LIPEADAM17
SCHEMBL6801500 0.89 ELANE (0.42) ELANECTRB1MEN1KMT2ATACR1
SCHEMBL6803263 0.87 ELANE (0.45) ELANECTRB1TACR1HCRTR1LIPE
SCHEMBL6506254 0.84 ELANE (0.41) ELANECTRB1TACR1RAB9A
SCHEMBL6505024 0.84 ELANE (0.40) ELANECTRB1MEN1KMT2ATACR1
SCHEMBL6801293 0.84 ELANE (0.41) ELANEMEN1KMT2ANPC1L3MBTL1
SCHEMBL6806821 0.80 ELANE (0.47) ELANECTRB1HCRTR1RAB9A
SCHEMBL7444707 0.79 ELANE (0.39) ELANECTRB1MEN1KMT2ATACR1
SCHEMBL6806041 0.79 ELANE (0.40) ELANECTRB1KMT2ATACR1HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, HAX1 ELANE 2176/4885CTRB1 2628/4885LPAR1 672/4885

“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.