SCHEMBL4932447

SCHEMBL4932447

CCOC(=O)c1c(O)c(N2CCCC2)nn(CCC(C)(C)C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 5/20 0.40
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
LMNA P02545 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CDC7 O00311 1/20 0.35
RECQL P46063 1/20 0.35
HTT P42858 1/20 0.35
PDE4B Q07343 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
SCHEMBL14038312 0.85 NPC1 (0.32) NPC1RAB9A
SCHEMBL4904456 0.84 KDM4E (0.37) KDM4EALDH1A1KMT2AMEN1NPC1
SCHEMBL14034638 0.79 KDM5A (0.32) NPC1RAB9A
SCHEMBL14088339 0.78 MAPK1 (0.52) KDM4EALDH1A1KMT2AMEN1LMNA
SCHEMBL14007538 0.77 NPC1 (0.33) NPC1RAB9A
SCHEMBL4900019 0.75 ALOX15 (0.39) KDM4EALDH1A1RXFP1L3MBTL1HTT
SCHEMBL4575054 0.72 KDM4E (0.45) KDM4EALDH1A1KMT2ALMNARECQL
SCHEMBL14006495 0.70 ALDH1A1 (0.40) KDM4EALDH1A1NPC1LMNARECQL
SCHEMBL4909426 0.67 ALDH1A1 (0.40) KDM4EALDH1A1KMT2AMEN1LMNA
SCHEMBL4574836 0.66 LMNA (0.41) KDM4EALDH1A1LMNARECQLHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008144500-A2 1-METHYL-BENZO[1,2,4]THIADIAZINE, 1-OXIDE DERIVATIVES ANADYS PHARMACEUTICALS, INC. (US) 2008-11-27 WO disclosed
WO-2008144500-A2 1-METHYL-BENZO[1,2,4]THIADIAZINE, 1-OXIDE DERIVATIVES ANADYS PHARMACEUTICALS, INC. (US) 2008-11-27 WO disclosed
US-20080292588-A1 1-METHYL-BENZO[1,2,4]THIADIAZINE 1-OXIDE DERIVATIVES ANADYS PHARMACEUTICALS, INC. (US) 2008-11-27 US disclosed
US-20080292588-A1 1-METHYL-BENZO[1,2,4]THIADIAZINE 1-OXIDE DERIVATIVES ANADYS PHARMACEUTICALS, INC. (US) 2008-11-27 US disclosed
US-20080292588-A1 1-METHYL-BENZO[1,2,4]THIADIAZINE 1-OXIDE DERIVATIVES ANADYS PHARMACEUTICALS, INC. (US) 2008-11-27 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-20080292588-A1 1-METHYL-BENZO[1,2,4]THIADIAZINE 1-OXIDE DERIVATIVES CYP1B1, CYP2E1, DAZAP1 KDM4E 668/4885ALDH1A1 143/4885KMT2A 1229/4885

“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.