SCHEMBL706984

SCHEMBL706984

COc1ccc2c(c1)N(CC=O)C(=O)CO2

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
CBX7 O95931 1/20 0.48
CDYL2 Q8N8U2 1/20 0.48
CDYL Q9Y232 1/20 0.48
CDY1; CDY1B Q9Y6F8 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.47
PIK3CG P48736 3/20 0.46
PLK1 P53350 1/20 0.45
HTT P42858 2/20 0.45
TSHR P16473 1/20 0.45
KCNH2 Q12809 2/20 0.45
MAPT P10636 3/20 0.44
HSD17B10 Q99714 1/20 0.44
USP2 O75604 1/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 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
SCHEMBL708034 0.82 L3MBTL1 (0.52) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL2947181 0.81 HTT (0.70) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4047656 0.80 L3MBTL1 (0.53) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4100445 0.78 L3MBTL1 (0.48) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4098128 0.78 ALOX15 (0.49) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4098126 0.78 ALOX15 (0.49) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4100446 0.78 L3MBTL1 (0.48) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4098310 0.78 L3MBTL1 (0.51) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL4098307 0.78 L3MBTL1 (0.51) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL26654963 0.77 PDE3B (0.49) L3MBTL1CBX7CDYL2CDYLCDY1; CDY1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108577-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-8124602-B2 Compounds for the treatment of multi-drug resistant bacterial infections ASTRAZENECA AB (SE) 2012-02-28 US disclosed
US-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2011-04-21 US disclosed
EP-2289890-A1 Compounds for the treatment of multi-drug resistant bacterial infections AstraZeneca AB (SE) 2011-03-02 EP disclosed
US-7875715-B2 6-[({1-[2-(7-methoxy-2-oxoquinoxalin-1(2H)-yl)ethyl]piperidin-4-yl}amino)methyl]-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one; antibacteria; methicillin-resistant Staphylococcus aureus (MRSA), methicillin-resistant coagulase-negative staphylococci (MRCNS), penicillin-resistant Streptococcus pneumoniae ASTRAZENECA AB (SE) 2011-01-25 US disclosed
US-20100152441-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2010-06-17 US disclosed
EP-1893599-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS AstraZeneca AB (SE) 2008-03-05 EP disclosed
WO-2006134378-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2006-12-21 WO 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 (3 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-20110092495-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK L3MBTL1 1630/4885CBX7 4017/4885CDYL2 4415/4885
US-20120108577-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK L3MBTL1 1630/4885CBX7 4017/4885CDYL2 4415/4885
US-20100152441-A1 COMPOUNDS FOR THE TREATMENT OF MULTI-DRUG RESISTANT BACTERIAL INFECTIONS PIGS, BPGM, IPMK L3MBTL1 1630/4885CBX7 4017/4885CDYL2 4415/4885

“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.