SCHEMBL8611284

SCHEMBL8611284

CC(C)(C)OC(=O)NCc1ccc(CC(N)=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
NAMPT P43490 2/20 0.50
CA2 P00918 2/20 0.50
CA1 P00915 2/20 0.50
GAA P10253 1/20 0.50
HDAC1 Q13547 2/20 0.46
GRM2 Q14416 1/20 0.45
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
RECQL P46063 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KDM4A O75164 1/20 0.44
HPN P05981 1/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43

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
SCHEMBL3180689 0.88 L3MBTL1 (0.61) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL30905374 0.87 L3MBTL1 (0.54) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL18295371 0.86 L3MBTL1 (0.54) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL1244728 0.86 EPHX2 (0.56) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL27426150 0.86 L3MBTL1 (0.53) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL14986954 0.85 GLS (0.57) NAMPTCA1GRM2KDM4ACA12
SCHEMBL5796279 0.85 L3MBTL1 (0.56) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL8143923 0.85 CA1 (0.51) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL5209897 0.84 L3MBTL1 (0.52) L3MBTL1NAMPTCA2CA1GAA
SCHEMBL8220824 0.84 EPHX2 (0.60) L3MBTL1NAMPTCA2CA1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328085-B2 Heterocyclic compounds and expansion agents for hematopoietic stem cells NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-05-03 US disclosed
US-20130245255-A1 HETEROCYCLIC COMPOUNDS AND EXPANSION AGENTS FOR HEMATOPOIETIC STEM CELLS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-09-19 US disclosed
US-20120128640-A1 HETEROCYCLIC COMPOUNDS AND EXPANSION AGENTS FOR HEMATOPOIETIC STEM CELLS NISSAN CHEMICAL INDUSTRIES LTD. (JP) 2012-05-24 US disclosed
US-4144391-A REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE ELI LILLY AND COMPANY (US) 1979-03-13 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 (2 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-20130245255-A1 HETEROCYCLIC COMPOUNDS AND EXPANSION AGENTS FOR HEMATOPOIETIC STEM CELLS HCLS1, RUNX1, RCC1 L3MBTL1 422/4885NAMPT 980/4885CA2 4023/4885
US-20120128640-A1 HETEROCYCLIC COMPOUNDS AND EXPANSION AGENTS FOR HEMATOPOIETIC STEM CELLS HCLS1, RUNX1, RCC1 L3MBTL1 422/4885NAMPT 980/4885CA2 4023/4885

“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.