SCHEMBL10874589

SCHEMBL10874589

NC(CCc1ccc([PH](=O)O)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 4/20 0.49
▸ GRIA1 P42261 2/20 0.49
▸ GRIA2 P42262 2/20 0.49
▸ GRIA3 P42263 2/20 0.49
▸ GRIA4 P48058 2/20 0.49
▸ GRIK2 Q13002 2/20 0.49
▸ GRIK3 Q13003 2/20 0.49
▸ SLC7A5 Q01650 3/20 0.42
▸ PTGS1 P23219 2/20 0.41
▸ ALPI P09923 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ XIAP P98170 1/20 0.41
▸ PMP22 Q01453 1/20 0.40
▸ KIF11 P52732 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ LCK P06239 1/20 0.39
▸ FYN P06241 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39

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
SCHEMBL354216 0.83 SLC7A5 (0.62) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL3629107 0.79 GRIK1 (0.54) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL1768639 0.79 SLC7A5 (0.67) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL3629108 0.79 GRIK1 (0.54) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL1666620 0.79 SLC7A5 (0.67) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL25356342 0.79 GRIK1 (0.54) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL6377896 0.79 GRIK1 (0.54) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL9394667 0.79 SLC7A5 (0.67) GRIK1GRIA1GRIA2GRIA3GRIA4
Homophenylalanine SCHEMBL44312 0.78 ALPI (0.64) GRIK1GRIA1GRIA2GRIA3GRIA4
Homophenylalanine SCHEMBL130567 0.78 ALPI (0.64) GRIK1GRIA1GRIA2GRIA3GRIA4

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-0085391-B1 PHOSPHINIC ACID DERIVATIVES AND PROCESS FOR PREPARING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 1986-01-15 — — EP disclosed
US-4510102-A FUNGICIDE;HERBICIDES;ALKYLALKYLPHOSPHONYL HALIDE STARTING MATERIAL MEIJI SEIKA KAISHA LTD. (JP) 1985-04-09 — — US disclosed
EP-0085391-A1 Phosphinic acid derivatives and process for preparing the same MEIJI SEIKA KAISHA LTD. (JP) 1983-08-10 — — EP disclosed
Send feedback