SCHEMBL3322985

SCHEMBL3322985

C=CCC(C(N)=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.35
GRIK2 Q13002 2/20 0.35
MMP2 P08253 2/20 0.35
MMP3 P08254 2/20 0.35
MMP7 P09237 2/20 0.35
MMP1 P03956 1/20 0.35
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
EPHX1 P07099 2/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
FGFR4 P22455 1/20 0.32
ECE1 P42892 2/20 0.32
CYP2C19 P33261 1/20 0.31
CPA1 P15085 1/20 0.31

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
Urea SCHEMBL29215668 0.83 SLC1A3 (0.45) GRIK1GRIK2MMP2MMP3MMP7
SCHEMBL13710824 0.81 SLC1A3 (0.37) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL10308328 0.81 SLC1A3 (0.37) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL27542515 0.81 MMP2 (0.41) GRIK1GRIK2MMP2MMP3MMP7
SCHEMBL4798136 0.79 SLC1A3 (0.45) GRIK1GRIK2MMP2MMP3MMP7
SCHEMBL2987274 0.79 SLC1A3 (0.45) GRIK1GRIK2MMP2MMP3MMP7
SCHEMBL3579874 0.79 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1EPHX1ECE1
SCHEMBL2987273 0.79 SLC1A3 (0.45) GRIK1GRIK2MMP2MMP3MMP7
SCHEMBL25832508 0.79 MMP2 (0.36) GRIK1GRIK2MMP2MMP3MMP7
Apronal SCHEMBL662209 0.78 MMP2 (0.37) GRIK1GRIK2MMP2MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200110-B1 IN VIVO INDUCTION FOR ENHANCED FUNCTION OF ISOLATED HEPATOCYTES ORGANOGENESIS INC (US) 2014-04-23 EP claimed
US-20090005437-A1 Alpha-Ketoglutarates and Their Use as Therapeutic Agents UNIVERSITY OF STRATHCLYDE (GB) 2009-01-01 US claimed
US-7169607-B2 In vivo induction for enhanced function of isolated hepatocytes ORGANOGENESIS, INC (US) 2007-01-30 US claimed
US-6699716-B2 HEPATOCYTES THAT HAVE INCREASED DETOXIFICATION ENZYME ACTIVITY WHEN ISOLATED FROM A LIVER OF A DONOR THAT HAD BEEN ADMINISTERED AT LEAST ONE INDUCTION AGENT PRIOR ISOLATION OF HEPATOCYTE CELLS. ORGANOGENESIS INC. 2004-03-02 US claimed
US-20040005303-A1 In vivo induction for enhanced function of isolated hepatocytes ORGANOGENESIS, INC. 2004-01-08 US claimed
US-20020085995-A1 In vivo induction for enhanced function of isolated hepatocytes SILICON VALLEY BANK 2002-07-04 US claimed
US-6394812-B1 LIVER CELL CULTURE ORGANOGENESIS INC. 2002-05-28 US claimed
CN-1273581-A Process and reagent for N-alkylation of ureides TARO PHARMA IND (IL) 2000-11-15 CN claimed
US-11311567-B2 Cytochrome P450 enzyme complexes and methods of treatment using the same INNOVATION HAMMER, LLC (US) 2022-04-26 US disclosed
US-11311566-B2 Cytochrome P450 enzyme complexes and methods of treatment using the same INNOVATION HAMMER, LLC (US) 2022-04-26 US disclosed
CN-113038933-A Oral pharmaceutical preparation containing ibuprofen SS制药株式会社 2021-06-25 CN disclosed
US-20210015838-A1 Cytochrome P450 Enzyme Complexes And Methods Of Treatment Using The Same INNOVATION HAMMER LLC (US) 2021-01-21 US disclosed
US-20200384008-A1 Cytochrome P450 Enzyme Complexes And Methods Of Treatment Using The Same INNOVATION HAMMER LLC (US) 2020-12-10 US disclosed
US-10786524-B2 Cytochrome P450 enzyme complexes and methods of treatment using the same INNOVATION HAMMER LLC (US) 2020-09-29 US disclosed
EP-1015030-A2 PHOTOCHEMOTHERAPEUTIC COMPOSITIONS Photocure AS (NO) 2000-07-05 EP disclosed
US-6020288-A PLANT GROWTH AGENT NONOMURA ARTHUR M (US) 2000-02-01 US disclosed
WO-1999012417-A1 METHODS AND COMPOSITIONS FOR ENHANCING CYTOCHROME P450 IN PLANTS NONOMURA ARTHUR M (US) 1999-03-18 WO disclosed
WO-1998030242-A2 PHOTOCHEMOTHERAPEUTIC COMPOSITIONS PHOTOCURE AS (NO) 1998-07-16 WO disclosed
WO-1996001426-A1 HEPATOCYTE TEST KIT W.R. GRACE & CO.-CONN. (US) 1996-01-18 WO disclosed
US-5008388-A For treatment of various types of anemia HUHTAMAKI OY (FI) 1991-04-16 US 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-20090005437-A1 Alpha-Ketoglutarates and Their Use as Therapeutic Agents HIF1A, HIF1AN, EGLN3 GRIK1 1917/4885GRIK2 2622/4885MMP2 1476/4885

“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.