SCHEMBL21067436

SCHEMBL21067436

N[C@@H](Cc1co[nH]c1=O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 5/20 0.49
GRIK1 P39086 4/20 0.47
GRIA1 P42261 4/20 0.47
GRIA3 P42263 4/20 0.47
GRIA4 P48058 4/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 3/20 0.47
KMT2A Q03164 3/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
GRIK5 Q16478 2/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP1A2 P05177 1/20 0.47
TSHR P16473 1/20 0.47
GRIK2 Q13002 1/20 0.47
GRIK3 Q13003 1/20 0.47
GRIK4 Q16099 1/20 0.47
MAPK1 P28482 1/20 0.47
BLM P54132 2/20 0.46

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
SCHEMBL3091518 0.69 MEN1 (0.46) GRIA2GRIK1GRIA1GRIA3GRIA4
SCHEMBL8355297 0.69 MEN1 (0.46) GRIA2GRIK1GRIA1GRIA3GRIA4
SCHEMBL10681106 0.68 KDM4E (0.51) MEN1MAPTKMT2AALDH1A1CYP2C9
SCHEMBL5286520 0.68 KDM4E (0.51) MEN1MAPTKMT2AALDH1A1CYP2C9
SCHEMBL28686231 0.68 MAPT (0.51) GRIA2GRIK1GRIA1GRIA3GRIA4
SCHEMBL13971424 0.67 SLC7A5 (0.69) MEN1MAPTKMT2AALDH1A1CYP2C9
SCHEMBL9164980 0.67 SLC7A5 (0.69) MEN1MAPTKMT2AALDH1A1CYP2C9
SCHEMBL28688811 0.67 CYP3A4 (0.64) GRIA2GRIK1GRIA1GRIA3GRIA4
SCHEMBL3635833 0.67 PKM (0.44) GRIA2GRIA1GRIA3MEN1MAPT
SCHEMBL3308687 0.67 USP2 (0.47) MEN1MAPTKMT2AALDH1A1CYP2C9

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-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 EP disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed