SCHEMBL594002

SCHEMBL594002

NC(CC(CC=Cc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 20/20 1.00
GRIK2 Q13002 20/20 1.00
GRIK3 Q13003 2/20 0.78

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
SCHEMBL594001 1.00 GRIK1 (1.00) GRIK1GRIK2GRIK3
SCHEMBL593999 1.00 GRIK1 (1.00) GRIK1GRIK2GRIK3
SCHEMBL594000 1.00 GRIK1 (1.00) GRIK1GRIK2GRIK3
SCHEMBL5958288 0.88 GRIK1 (0.78) GRIK1GRIK2GRIK3
SCHEMBL5958005 0.88 GRIK1 (0.78) GRIK1GRIK2GRIK3
SCHEMBL5958061 0.88 GRIK1 (0.78) GRIK1GRIK2GRIK3
SCHEMBL1865552 0.85 GRIK1 (0.73) GRIK1GRIK2GRIK3
SCHEMBL3579937 0.85 GRIK1 (0.73) GRIK1GRIK2GRIK3
SCHEMBL8087387 0.85 GRIK1 (0.73) GRIK1GRIK2GRIK3
SCHEMBL504608 0.85 GRIK1 (0.73) GRIK1GRIK2GRIK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9629911-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-04-25 US disclosed
US-20150224193-A1 PHOTOREACTIVE REGULATOR OF PROTEIN FUNCTION AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-08-13 US disclosed
US-9097707-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-08-04 US disclosed
US-20130137113-A1 Photoreactive Regulator of Protein Function and Methods of Use Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-05-30 US disclosed
US-8309350-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-13 US disclosed
US-20120190094-A1 Photoreactive Regulator of Protein Function and Methods of Use Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2012-07-26 US disclosed
US-8114843-B2 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-14 US disclosed
US-20070128662-A1 Photoreactive regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2007-06-07 US disclosed
EP-0656345-B1 Aspartic acid derivatives or homologues thereof and their use in the treatment of neurological diseases UNIV PASTEUR (FR) 1999-03-10 EP disclosed
US-5739164-A BLOCK METABOTROPIC GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 1998-04-14 US disclosed
US-5589501-A TREATMENT OF NEUROLOGICAL DISEASES, ANTIPSYCHOTIC, ANTICONVULSANT, ANALGESIC AND ANTIEMETIC AGENT ELI LILLY AND COMPANY (US) 1996-12-31 US disclosed
EP-0656345-A1 Aspartic acid derivatives or homologues thereof and their use in the treatment of neurological diseases Université Louis Pasteur (FR) 1995-06-07 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-20150224193-A1 PHOTOREACTIVE REGULATOR OF PROTEIN FUNCTION AND METHODS OF USE THEREOF PPP1R10, PPP6R3, ANKRD52 GRIK1 3703/4885GRIK2 3511/4885GRIK3 3846/4885
US-20070128662-A1 Photoreactive regulator of protein function and methods of use thereof PPP1R10, PPP6R3, ANKRD52 GRIK1 3703/4885GRIK2 3511/4885GRIK3 3846/4885

“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.