SCHEMBL21058313

SCHEMBL21058313

CC(C)(C)OC(=O)C(C)(N)Br

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.46
BCHE P06276 1/20 0.32
MAPK1 P28482 1/20 0.32
ELANE P08246 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
GRM6 O15303 1/20 0.31
NPC1 O15118 1/20 0.30
RECQL P46063 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL1352474 0.84 DGAT1 (0.46) DGAT1BCHEELANECA12CA1
SCHEMBL320271 0.78 DGAT1 (0.50) DGAT1BCHEELANECA1CA2
SCHEMBL11552854 0.78 DGAT1 (0.50) DGAT1BCHEMAPK1ELANENPC1
SCHEMBL161854 0.78 DGAT1 (0.50) DGAT1BCHEMAPK1ELANENPC1
SCHEMBL27747511 0.78 DGAT1 (0.50) DGAT1BCHEELANECA1CA2
SCHEMBL6687359 0.78 DGAT1 (0.50) DGAT1BCHEELANECA1CA2
SCHEMBL14606262 0.78 DGAT1 (0.50) DGAT1BCHEMAPK1ELANENPC1
Hydrochloric Acid SCHEMBL16632764 0.76 DGAT1 (0.48) DGAT1CA1CA2SMN1; SMN2
SCHEMBL10892362 0.76 DGAT1 (0.48) DGAT1CA1CA2SMN1; SMN2
SCHEMBL5870536 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240058458-A1 METHODS, COMPOUNDS, AND COMPOSITIONS FOR MODIFYING CAR-T CELL ACTIVITY PURDUE RESEARCH FOUNDATION (US) 2024-02-22 US disclosed
US-10675354-B2 Glycosaminoglycan derivative and method for producing same SEIKAGAKU CORPORATION (JP) 2020-06-09 US disclosed
US-20200155694-A1 GLYCOSAMINOGLYCAN DERIVATIVE AND METHOD FOR PRODUCING SAME SEIKAGAKU CORPORATION (JP) 2020-05-21 US disclosed
US-20190184023-A1 GLYCOSAMINOGLYCAN DERIVATIVE AND METHOD FOR PRODUCING SAME SEIKAGAKU CORPORATION (JP) 2019-06-20 US disclosed
CN-101921347-B Hyaluronic acid derivative and drug containing the same SEIKAGAKU KOGYO CO LTD 2014-07-30 CN disclosed
CN-102079746-A Pyrazolo-quinazoline derivatives,process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2011-06-01 CN disclosed
CN-1930190-B Hyaluronic acid derivative and drug containing same SEIKAGAKU KOGYO CO LTD 2011-04-20 CN disclosed
CN-101921347-A Derivatives of hyaluronic acids and contain its medicament SEIKAGAKU KOGYO CO LTD 2010-12-22 CN disclosed
CN-1930190-A Hyaluronic acid derivative and drug containing same SEIKAGAKU KOGYO CO LTD (JP) 2007-03-14 CN disclosed
CN-1293055-C Piperidine derivative crystal, midbody for preparation and preparing method AJINOMOTO KK (JP) 2007-01-03 CN disclosed
CN-1826343-A Pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors PHARMACIA ITALIA SPA (IT) 2006-08-30 CN disclosed
CN-1515553-A Piperidine derivative crystal, midbody for preparation and preparing method ֮����ʽ���� 2004-07-28 CN disclosed
CN-1121402-C Crystal of piperidine derivative, intermediate for production thereof, and process for production thereof AJINOMOTO KK (JP) 2003-09-17 CN disclosed
CN-1151403-A Crystal of piperidine derivative, intermediate for production thereof, and process for production thereof AJINOMOTO KK (JP) 1997-06-11 CN 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 (4 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-20240058458-A1 METHODS, COMPOUNDS, AND COMPOSITIONS FOR MODIFYING CAR-T CELL ACTIVITY ICOS, CD4, NFATC1 DGAT1 397/4885BCHE 293/4885MAPK1 3056/4885
US-20200155694-A1 GLYCOSAMINOGLYCAN DERIVATIVE AND METHOD FOR PRODUCING SAME CSGALNACT1, CD44, GUSB DGAT1 1104/4885BCHE 807/4885MAPK1 4458/4885
US-10675354-B2 Glycosaminoglycan derivative and method for producing same CSGALNACT1, CD44, GUSB DGAT1 1104/4885BCHE 807/4885MAPK1 4458/4885
US-20190184023-A1 GLYCOSAMINOGLYCAN DERIVATIVE AND METHOD FOR PRODUCING SAME CSGALNACT1, CD44, GUSB DGAT1 1104/4885BCHE 807/4885MAPK1 4458/4885

“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.