SCHEMBL6413331

SCHEMBL6413331

COC(=O)c1ccc(/C=C/c2ccccc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.54
MAPK1 P28482 2/20 0.54
KDM4E B2RXH2 2/20 0.54
KMT2A Q03164 4/20 0.51
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
GLA P06280 1/20 0.51
RAB9A P51151 8/20 0.49
NPC1 O15118 5/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSD17B10 Q99714 1/20 0.49
POLB P06746 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 2/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL6413338 1.00 L3MBTL1 (0.54) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL6641237 0.87 MAPK1 (0.51) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL6641242 0.87 MAPK1 (0.51) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL2400709 0.85 MAPT (0.62) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL2400706 0.85 MAPT (0.62) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL30644141 0.85 KMT2A (0.52) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL26643204 0.85 KMT2A (0.52) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL31516495 0.84 MAOB (0.53) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL26643224 0.84 MAOB (0.53) L3MBTL1MAPK1KDM4EKMT2AMAPT
SCHEMBL2665951 0.84 MAPK1 (0.51) L3MBTL1MAPK1KDM4EKMT2AMAPT

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-20070093535-A1 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB 2007-04-26 US disclosed
US-20070093535-A1 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB 2007-04-26 US disclosed
US-7199140-B2 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB (SE) 2007-04-03 US disclosed
US-7199140-B2 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB (SE) 2007-04-03 US disclosed
EP-1404682-B1 METHOD OF INHIBITING PTP 1B AND/OR T-CELL PTP AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK AS (DK) 2005-09-14 EP disclosed
EP-1404682-A1 METHOD OF INHIBITING PTP 1B AND/OR T-CELL PTP AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 Novo Nordisk A/S (DK) 2004-04-07 EP disclosed
US-20030064979-A1 Method of inhibiting PTP 1B and /or T-cell PTP and/or other PTPases with an Asp residue at position 48 NOVO NORDISK A/S (DK) 2003-04-03 US disclosed
WO-2003002569-A1 METHOD OF INHIBITING PTP 1B AND/OR T-CELL PTP AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 NOVO NORDISK A/S (DK) 2003-01-09 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 (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-20070093535-A1 Vinyl phenyl derivatives as GLK activators GCK, GCKR, GK L3MBTL1 2810/4885MAPK1 565/4885KDM4E 1062/4885
US-20030064979-A1 Method of inhibiting PTP 1B and /or T-cell PTP and/or other PTPases with an Asp residue at position 48 PTPRO, PTPRF, PTPA L3MBTL1 2126/4885MAPK1 594/4885KDM4E 3055/4885

“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.