SCHEMBL6806545

SCHEMBL6806545

Cc1c(CN(Cc2ccccc2)C(=O)O)ccc2nc(N[C@@H](Cc3ccc(Cl)cc3)C(=O)N(C)Cc3ccccc3)oc(=O)c12

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.43
CTRB1 P17538 3/20 0.43
RAB9A P51151 1/20 0.37
AVPR1A P37288 3/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL6806821 0.95 ELANE (0.47) ELANECTRB1RAB9AHPGD
SCHEMBL6805565 0.92 ELANE (0.43) ELANECTRB1MEN1KMT2A
SCHEMBL6809911 0.91 ELANE (0.44) ELANECTRB1RAB9A
SCHEMBL6500724 0.91 ELANE (0.43) ELANECTRB1RAB9A
SCHEMBL6802038 0.90 ELANE (0.48) ELANECTRB1RAB9AHPGD
SCHEMBL6803767 0.90 ELANE (0.42) ELANECTRB1RAB9AMEN1KMT2A
SCHEMBL6497830 0.89 LMNA (0.45) ELANECTRB1RAB9AMEN1KMT2A
SCHEMBL6504209 0.89 CTRB1 (0.46) ELANECTRB1RAB9AMEN1KMT2A
SCHEMBL6803263 0.89 ELANE (0.45) ELANECTRB1
SCHEMBL6799605 0.88 ELANE (0.41) ELANECTRB1

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-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 claimed
US-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. 2003-01-30 US claimed
US-6380189-B1 FOR TREATING HERPES-RELATED DISORDERS G.D. SEARLE & CO. 2002-04-30 US claimed
EP-0828721-B1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS SEARLE & CO (US) 2001-11-14 EP claimed
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 2628/4885RAB9A 1233/4885

“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.