SCHEMBL2185099

SCHEMBL2185099

C=C(NCC(=O)O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.41
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 1/20 0.39
PTGS2 P35354 1/20 0.39
CTH P32929 1/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APEX1 P27695 1/20 0.35
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
ECE1 P42892 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HIF1A Q16665 1/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
MME P08473 2/20 0.33
PLA2G2A P14555 1/20 0.33
ABAT P80404 1/20 0.33

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
SCHEMBL11293073 0.79 CTH (0.44) EGLN1MAPTALDH1A1TDP1LMNA
SCHEMBL24709385 0.79 CTH (0.44) EGLN1MAPTALDH1A1TDP1LMNA
SCHEMBL28078070 0.75 TET2 (0.50) EGLN1ALDH1A1LMNAHSD17B10KDM4E
SCHEMBL15063182 0.74 ECE1 (0.46) EGLN1LMNAECE1KDM4ESLC22A6
SCHEMBL322850 0.72
SCHEMBL10350050 0.72
SCHEMBL8076846 0.72
SCHEMBL10391331 0.72
SCHEMBL10350087 0.72
N-Oxalylglycine SCHEMBL435820 0.71 EGLN1 (0.56) EGLN1MAPTALDH1A1TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110177004-A1 Version of FDG Detectable by Single-Photon Emission Computed Tomography OCERA THERAPEUTICS LLC (F/K/A OCERA THERAPEUTICS, INC.) 2011-07-21 US claimed
EP-2341944-A2 CONJUGATES OF HEXOSE AND METAL COORDINATING COMPOUNDS FOR IMAGING PURPOSES Mallinckrodt Inc. (US) 2011-07-13 EP claimed
WO-2010039609-A2 A VERSION OF FDG DETECTABLE BY SINGLE-PHOTON EMISSION COMPUTED TOMOGRAPHY MALLINCKRODT INC. (US) 2010-04-08 WO claimed
WO-1999021587-A1 COMPLEXING AGENTS AND TARGETING IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1999-05-06 WO claimed
US-5760191-A Macrocyclic complexing agents and targeting immunoreagents useful in therapeutic and diagnostic compositions and methods NYCOMED IMAGING AS (NO) 1998-06-02 US claimed
EP-0624097-B1 TARGETING RADIOACTIVE IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1998-03-18 EP claimed
US-5707603-A Pyridine complexing agents and targeting immunoreagents useful in therapeutic and diagnostic compositions NYCOMED IMAGING AS (NO) 1998-01-13 US claimed
EP-0732620-A1 Composition for developing an exposed photographic product having improved biodegradability KODAK-PATHE (FR) 1996-09-18 EP claimed
EP-0639083-A1 COMPLEXING AGENTS AND TARGETING IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1995-02-22 EP claimed
US-5367080-A PYRIDINE DERIVATIVES STERLING WINTHROP INC. (US) 1994-11-22 US claimed
EP-0624097-A1 TARGETING RADIOACTIVE IMMUNOREAGENTS NYCOMED IMAGING AS (NO) 1994-11-17 EP claimed
WO-1993021957-A1 COMPLEXING AGENTS AND TARGETING IMMUNOREAGENTS STERLING WINTHROP INC. (US) 1993-11-11 WO claimed
EP-0487903-B1 PROCESS FOR THE PREPARATION OF 1,3 PROPANEDIOL Degussa Aktiengesellschaft (DE) 1993-04-14 EP claimed
US-5171898-A Hydration of acrolein followed by hydrogenation of formed hydroxyaldehyde; using chelate-forming ion exchange resins, with iminoacid anchoring groups DEGUSSA AKTIENGESELLSCHAFT (DE) 1992-12-15 US claimed
WO-1992008494-A2 TARGETING RADIOACTIVE IMMUNOREAGENTS STERLING WINTHROP INC. (US) 1992-05-29 WO claimed
US-4837169-A RADIOIMMUNOASSAY EASTMAN KODAK COMPANY (US) 1989-06-06 US claimed
EP-0288256-A2 Fluorescent labels EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-10-26 EP claimed
JP-1045365-A None JP disclosed
US-4837169-A RADIOIMMUNOASSAY EASTMAN KODAK COMPANY (US) 1989-06-06 US disclosed
EP-0288256-A2 Fluorescent labels EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-10-26 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 (1 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-20110177004-A1 Version of FDG Detectable by Single-Photon Emission Computed Tomography SLC2A1, SLC2A4, SLC2A3 EGLN1 1572/4885MAPT 818/4885ALDH1A1 959/4885

“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.