SCHEMBL6807033

SCHEMBL6807033

Cc1c(NC(=O)CN(C)C)ccc2oc(NCCc3ccccc3)nc(=O)c12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 1/20 0.50
HDAC6 Q9UBN7 1/20 0.44
ELANE P08246 1/20 0.41
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 3/20 0.37
POLB P06746 2/20 0.37
GLS O94925 1/20 0.36
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 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
SCHEMBL6498375 0.86 CTRB1 (0.68) CTRB1HDAC6ELANEALDH1A1GLS
SCHEMBL6497237 0.75 CTRB1 (0.55) CTRB1HDAC6ELANEPOLBTP53
SCHEMBL6803206 0.73 CTRB1 (0.52) CTRB1HDAC6ELANE
SCHEMBL6506565 0.71 ELANE (0.53) CTRB1HDAC6ELANEALDH1A1KMT2A
SCHEMBL27355463 0.70 CTRB1 (0.38) CTRB1ALDH1A1NPC1POLBGLS
SCHEMBL6498652 0.70 CTRB1 (0.49) CTRB1HDAC6ELANEALDH1A1KMT2A
SCHEMBL6499627 0.69 CTRB1 (0.47) CTRB1ELANEALDH1A1NPC1KMT2A
SCHEMBL6496069 0.69 ELANE (0.50) CTRB1HDAC6ELANEALDH1A1NPC1
SCHEMBL6504081 0.68 ELANE (0.67) CTRB1HDAC6ELANEALDH1A1
SCHEMBL6498365 0.67 CTRB1 (1.00) CTRB1ELANE

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 2 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

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 CTRB1 2628/4885HDAC6 634/4885ELANE 2176/4885

“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.