SCHEMBL6691599

SCHEMBL6691599

CC(C)(C)OC(=O)Nc1ccc2c(c1C(=O)NN)C(=O)c1ccccc1C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
PTPRC P08575 2/20 0.41
MALT1 Q9UDY8 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MMP14 P50281 1/20 0.40
TERT O14746 3/20 0.39
CYP1A2 P05177 2/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 4/20 0.39
MITF O75030 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TDP2 O95551 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
DNMT1 P26358 1/20 0.38
RAD52 P43351 1/20 0.38

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
SCHEMBL18623980 0.78 MEN1 (0.61) MAOAMALT1MEN1KMT2AMMP14
SCHEMBL18623984 0.72 MALT1 (0.44) MALT1MEN1KMT2ATERTPOLB
SCHEMBL22336061 0.70 PTPRC (0.63) MAOAPTPRCMEN1KMT2ACYP1A2
SCHEMBL29465938 0.70 PTPRC (0.63) MAOAPTPRCMEN1KMT2ACYP1A2
SCHEMBL2880191 0.69 LMNA (0.54) MEN1KMT2AALDH1A1POLBGAA
SCHEMBL3822356 0.68 CA12 (0.42) MEN1KMT2APOLBGAAELANE
SCHEMBL18295333 0.67 LMNA (0.45) TSHRMAPTALDH1A1POLBGAA
SCHEMBL22007092 0.67 PTPRC (0.63) MAOAPTPRCMEN1KMT2ACYP1A2
SCHEMBL3788603 0.67 HSP90AA1 (0.46) MAOAMALT1MEN1KMT2AMMP14
SCHEMBL11742788 0.67 MAOA (0.73) MAOAPTPRCMEN1KMT2ATERT

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-6824998-B2 FOR DETERMINATION IN MAMMALS VIA 1-ANTHRAQUINONYLHYDRAZIDE WITH P-ANIALDEHYDE; DRUG SCREENING; PACKAGING; KITS UNIVERSITY OF IOWA RESEARCH FOUNDATION 2004-11-30 US disclosed
WO-2004083861-A1 COMPOUNDS AND METHODS FOR DETECTING TRIPEPTIDYL PROTEASE I UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2004-09-30 WO disclosed
US-20040185520-A1 Compounds and methods for detecting tripeptidyl protease I AKRION, INC. 2004-09-23 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-20040185520-A1 Compounds and methods for detecting tripeptidyl protease I TPP1, DNPEP, TPP2 MAOA 2137/4885PTPRC 2678/4885MALT1 3432/4885

“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.