SCHEMBL3466396

SCHEMBL3466396

CC(C)(C)OC(=O)N[C@H](CO)CCC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.57
ATM Q13315 1/20 0.51
PPARA Q07869 3/20 0.48
MAPT P10636 1/20 0.48
KLK7 P49862 1/20 0.47
KLK5 Q9Y337 1/20 0.47
CTSS P25774 4/20 0.46
CTSL P07711 2/20 0.45
CTSK P43235 3/20 0.45
ACE P12821 1/20 0.45
CTRB1 P17538 2/20 0.44
PPARG P37231 2/20 0.44
CTSB P07858 1/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
TLR2 O60603 1/20 0.43
TLR1 Q15399 1/20 0.43
APP P05067 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
SCHEMBL24298360 1.00 SYK (0.57) SYKATMPPARAMAPTKLK7
SCHEMBL3466395 1.00 SYK (0.57) SYKATMPPARAMAPTKLK7
SCHEMBL25907995 0.92 SYK (0.56) SYKATMPPARAMAPTKLK7
SCHEMBL1556449 0.91 SYK (0.60) SYKATMPPARAMAPTCTSS
SCHEMBL143120 0.91 SYK (0.60) SYKATMPPARAMAPTCTSS
SCHEMBL17513638 0.89 SYK (0.56) SYKATMPPARAMAPTKLK7
SCHEMBL18575403 0.89 SYK (0.56) SYKATMPPARAMAPTKLK7
SCHEMBL25318929 0.89 SYK (0.56) SYKATMPPARAMAPTKLK7
SCHEMBL8607451 0.88 SYK (0.55) SYKATMPPARAMAPTKLK7
SCHEMBL3108565 0.88 SYK (0.59) SYKATMPPARAMAPTKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 EP disclosed
CN-115989228-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-04-18 CN disclosed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 US disclosed
US-8946224-B2 Substituted [1,2,4]triazolo[4,3-A]pyrazines for medicaments and pharmaceutical compositions REDX PHARMA LIMITED (GB) 2015-02-03 US disclosed
US-8946224-B2 Substituted [1,2,4]triazolo[4,3-A]pyrazines for medicaments and pharmaceutical compositions REDX PHARMA LIMITED (GB) 2015-02-03 US disclosed
US-20130225594-A1 DRUG DERIVATIVES REDX PHARMA PLC (GB) 2013-08-29 US disclosed
US-20130225594-A1 DRUG DERIVATIVES REDX PHARMA PLC (GB) 2013-08-29 US disclosed
WO-2012063085-A2 DRUG DERIVATIVES REDX PHARMA LIMITED (GB) 2012-05-18 WO disclosed
US-7767690-B2 Amino alcohol derivatives and their use as renin inhibitor NOVARTIS AG (CH) 2010-08-03 US disclosed
US-20100063013-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-03-11 US disclosed
US-20100063013-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-03-11 US disclosed
US-20090118281-A1 Amino Alcohol Derivatives And Their Use As Renin Inhibitor NOVARTIS AG (CH) 2009-05-07 US disclosed
EP-1711456-A2 AMINO ALCOHOL DERIVATIVES AND THEIR USE AS RENIN INHIBITORS Speedel Experimenta AG (CH) 2006-10-18 EP disclosed
WO-2005070870-A2 AMINO ALCOHOL DERIVATIVES AND THEIR USE AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2005-08-04 WO disclosed
CN-1409720-A Aminoalkyl glucosaminide phosphate compounds and their use as adjuvants and immunoeffectors CORIXA CORP (US) 2003-04-09 CN disclosed
CN-1311771-A Benzamidine derivative AJINOMOTO KK (JP) 2001-09-05 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-20220098176-A1 HETEROCYCLIC COMPOUNDS CBR3, BRIX1, CCNY SYK 3902/4885ATM 4075/4885PPARA 3771/4885
US-20130225594-A1 DRUG DERIVATIVES SQOR, NQO1, CYP2D6 SYK 1103/4885ATM 4457/4885PPARA 1494/4885
US-20100063013-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS CTSS, CTSB, CTSZ SYK 1838/4885ATM 4487/4885PPARA 3869/4885
US-20090118281-A1 Amino Alcohol Derivatives And Their Use As Renin Inhibitor REN, AGTR1, ADH1A SYK 4369/4885ATM 2741/4885PPARA 2811/4885

“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.