SCHEMBL756295

SCHEMBL756295

O=C(O)C=CCN1C(=O)C=CC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.43
PTGS1 P23219 5/20 0.40
PTGS2 P35354 5/20 0.40
GSK3A P49840 3/20 0.40
GSK3B P49841 3/20 0.40
MGLL Q99685 7/20 0.38
BLM P54132 4/20 0.38
LMNA P02545 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
ALDH1A1 P00352 3/20 0.38
FAAH O00519 3/20 0.38
GABRR1 P24046 2/20 0.38
GABRR2 P28476 2/20 0.38
MAPT P10636 2/20 0.38
GMNN O75496 1/20 0.38
THPO P40225 1/20 0.38
PMP22 Q01453 1/20 0.38
GABRR3 A8MPY1 1/20 0.38
TSHR P16473 1/20 0.38
APEX1 P27695 1/20 0.38

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
SCHEMBL27601261 0.82 GSK3A (0.39) AKR1B1PTGS1PTGS2GSK3AGSK3B
Maleic Acid SCHEMBL10339012 0.78 MGLL (0.52) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL822301 0.76 MGLL (0.42) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL10713815 0.73 CA12 (0.55) AKR1B1NPSR1ALDH1A1MAPTRAB9A
SCHEMBL10713825 0.73 CA12 (0.55) AKR1B1NPSR1ALDH1A1MAPTRAB9A
SCHEMBL1955696 0.71 MGLL (0.42) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL3813599 0.71 MGLL (0.44) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL6537077 0.71 MGLL (0.48) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL9414034 0.71 MGLL (0.42) PTGS1PTGS2GSK3AGSK3BMGLL
SCHEMBL9181540 0.71 MGLL (0.48) PTGS1PTGS2GSK3AGSK3BMGLL

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3620177-A1 MODIFIED BLOOD FACTORS COMPRISING A LOW DEGREE OF WATER SOLUBLE POLYMER Baxalta GmbH (CH) 2020-03-11 EP disclosed
US-20190160178-A1 MODIFIED BLOOD FACTORS COMPRISING A LOW DEGREE OF WATER SOLUBLE POLYMER TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-05-30 US disclosed
EP-3437661-A1 MODIFIED BLOOD FACTORS COMPRISING A LOW DEGREE OF WATER SOLUBLE POLYMER Baxalta GmbH (CH) 2019-02-06 EP disclosed
EP-2349342-B1 MODIFIED BLOOD FACTORS COMPRISING A LOW DEGREE OF WATER SOLUBLE POLYMER Baxalta GmbH (CH) 2018-06-27 EP disclosed
US-20170227557-A1 METHOD AND COMPOSITIONS FOR SPECIFICALLY DETECTING PHYSIOLOGICALLY ACCEPTABLE POLYMER MOLECULES BAXTER HEALTHCARE SA (CH) 2017-08-10 US disclosed
US-9547016-B2 Method and compositions for specifically detecting physiologically acceptable polymer molecules BAXALTA INCORPORATED (US) 2017-01-17 US disclosed
US-20160199503-A1 MODIFIED BLOOD FACTORS COMPRISING A LOW DEGREE OF WATER SOLUBLE POLYMER BAXTER INTERNATIONAL INC. 2016-07-14 US disclosed
US-9274122-B2 Methods for determining active ingredients in pro-drug PEG protein conjugates with releasable PEG reagents (in vitro de-pegylation) BAXALTA INCORPORATED (US) 2016-03-01 US disclosed
US-20140051094-A1 Method and Compositions for Specifically Detecting Physiologically Acceptable Polymer Molecules BAXTER HEALTHCARE SA (CH) 2014-02-20 US disclosed
US-8557534-B2 Method and compositions for specifically detecting physiologically acceptable polymer molecules BAXTER INTERNATIONAL INC. (US) 2013-10-15 US disclosed
EP-1597299-A2 CARBONATE ESTERS OF POLYETHYLENE GLYCOL ACTIVATED BY MEANS OF OXALATE ESTERS Pharmacia Corporation (US) 2005-11-23 EP disclosed
US-20040242854-A1 Chemical capture reagent GE HEALTHCARE UK LIMITED (GB) 2004-12-02 US disclosed
WO-2004074345-A2 CARBONATE ESTERS OF POLYETHYLENE GLYCOL ACTIVATED BY MEANS OF OXALATE ESTERS PHARMACIA CORPORATION (US) 2004-09-02 WO disclosed
US-20040162388-A1 Activated polyethylene glycol esters PHARMACIA CORPORATION 2004-08-19 US disclosed
EP-1402268-A2 CHEMICAL CAPTURE REAGENT Amersham Biosciences UK Limited (GB) 2004-03-31 EP disclosed
US-20040029207-A1 Compositions and methods for detecting and quantifying COX-2 activity by lipoamino acid metabolism NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-02-12 US disclosed
WO-2003014699-A2 COMPOSITIONS AND METHODS FOR DETECTING AND QUANTIFYING COX-2 ACTIVITY BY LIPOAMINO ACID METABOLISM VANDERBILT UNIVERSITY (US) 2003-02-20 WO disclosed
WO-2003005026-A2 CHEMICAL CAPTURE REAGENT AMERSHAM BIOSCIENCES UK LIMITED (GB) 2003-01-16 WO disclosed
JP-2002256025-A METHOD FOR PRODUCING AQUEOUS POWDER SLURRY COMPOSITION DAINIPPON INK & CHEM INC 2002-09-11 JP disclosed
EP-0847991-A1 Method for the preparation of N-(carboxyalkyl) imides DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-06-17 EP 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-20040162388-A1 Activated polyethylene glycol esters ACP1, FGF23, ACP3 AKR1B1 3723/4885PTGS1 1403/4885PTGS2 2029/4885
US-20040242854-A1 Chemical capture reagent SPPL2B, PRXL2A, PLG AKR1B1 1893/4885PTGS1 1219/4885PTGS2 2425/4885

“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.