SCHEMBL21345666

SCHEMBL21345666

CCC(=O)[C@H](N)CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR3 O14843 1/20 0.43
▸ GRIK1 P39086 3/20 0.42
▸ GRIA4 P48058 2/20 0.42
▸ GRIK3 Q13003 2/20 0.42
▸ GRIK5 Q16478 2/20 0.42
▸ SLC22A6 Q4U2R8 1/20 0.38
▸ BHMT Q93088 1/20 0.37
▸ GABRR1 P24046 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SLC1A3 P43003 2/20 0.37
▸ SLC1A2 P43004 2/20 0.37
▸ SLC1A1 P43005 2/20 0.37
▸ GRIK2 Q13002 2/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ GABRP O00591 2/20 0.36
▸ GABRD O14764 2/20 0.36
▸ GABRA1 P14867 2/20 0.36
▸ GABRB1 P18505 2/20 0.36

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
SCHEMBL33273 1.00 FFAR3 (0.43) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL16359636 1.00 FFAR3 (0.43) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL13146871 0.81 FFAR3 (0.46) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL14771690 0.80 GRIK1 (0.38) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL21345146 0.80 GRIK1 (0.38) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL16021873 0.80 TDP1 (0.43) FFAR3GRIK1GRIA4GRIK3GRIK5
Aspartic Acid SCHEMBL7781260 0.80 GRIK1 (0.57) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL16024166 0.80 ALDH1A1 (0.43) FFAR3GRIK1GRIA4GRIK3GRIK5
Aspartic Acid SCHEMBL135731 0.80 GRIK1 (0.57) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL10068031 0.80 GRIK1 (0.38) FFAR3GRIK1GRIA4GRIK3GRIK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066425-B1 Oxo-substituted compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-07-20 — — US disclosed
WO-2019173602-A1 4'-HALOGEN CONTAINING NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2019-09-12 — — WO 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-11066425-B1 Oxo-substituted compound CYP51A1, OXA1L, O60361 FFAR3 4629/4885GRIK1 2762/4885GRIA4 3920/4885

“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.

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