SCHEMBL5002016

SCHEMBL5002016

CC(C)C(C/C=C\Cl)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.44
GRIK2 Q13002 1/20 0.44
SLC1A3 P43003 1/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC7A5 Q01650 1/20 0.31
TP53 P04637 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
SCHEMBL5264842 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2232483 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL622161 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2232479 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL5264845 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL622162 1.00 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2031192 0.86 SLC1A3 (0.48) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL8101229 0.86 SLC1A3 (0.48) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2035309 0.86 SLC1A3 (0.48) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL6871010 0.86 SLC1A3 (0.48) GRIK1GRIK2SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1961728-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE (4E)-5-CHLORO-2-ISOPROPYL-4-PENTENOIC ACID OR BASIC AMINO ACID SALT THEREOF ASAHI GLASS CO LTD (JP) 2013-12-11 EP disclosed
US-20080255385-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE (4E)-5-CHLORO-2-ISOPROPYL-4-PENTENOIC ACID OR BASIC AMINO ACID SALT THEREOF ASAHI GLASS COMPANY, LIMTED (JP) 2008-10-16 US disclosed
EP-1961728-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE (4E)-5-CHLORO-2-ISOPROPYL-4-PENTENOIC ACID OR BASIC AMINO ACID SALT THEREOF Asahi Glass Co., Ltd. (JP) 2008-08-27 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-20080255385-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE (4E)-5-CHLORO-2-ISOPROPYL-4-PENTENOIC ACID OR BASIC AMINO ACID SALT THEREOF PLAAT5, ELOVL5, SLC7A1 GRIK1 517/4885GRIK2 310/4885SLC1A3 193/4885

“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.