SCHEMBL20528879

SCHEMBL20528879

NC(C(=O)O)C(O)C1CC2C=CC1C2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
SLC1A2 P43004 3/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
APEX1 P27695 1/20 0.32
GRM5 P41594 1/20 0.32
PMP22 Q01453 1/20 0.32
GRM1 Q13255 1/20 0.32
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
GRM4 Q14833 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX2 P34913 2/20 0.31
SLC1A1 P43005 2/20 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
SCHEMBL22009108 1.00 KDM4E (0.40) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL22009120 1.00 KDM4E (0.40) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL22009110 1.00 KDM4E (0.40) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL22009191 1.00 KDM4E (0.40) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL22009109 1.00 KDM4E (0.40) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL14053439 0.80 GRM5 (0.47) KDM4ELMNASLC1A2CYP2C9CYP2C19
SCHEMBL22941781 0.73 KDM4E (0.39) KDM4ELMNAAPEX1EPHX2
SCHEMBL25946742 0.73 KDM4E (0.39) KDM4ELMNAAPEX1EPHX2
SCHEMBL3293689 0.73 KDM4E (0.39) KDM4ELMNAAPEX1MEN1KMT2A
SCHEMBL10347490 0.73 KDM4E (0.39) KDM4ELMNAMEN1KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287383-A1 PYRROLYSYL-tRNA SYNTHETASE VARIANTS AND USES THEREOF ENGENES BIOTECH GMBH (AT) 2023-09-14 US disclosed
EP-4176050-A1 PYRROLYSYL-TRNA SYNTHETASE VARIANTS AND USES THEREOF enGenes Biotech GmbH (AT) 2023-05-10 EP disclosed
WO-2022003142-A1 PYRROLYSYL-tRNA SYNTHETASE VARIANTS AND USES THEREOF ENGENES BIOTECH GMBH (AT) 2022-01-06 WO disclosed
WO-2018185222-A1 AMINOACYL TRNA SYNTHETASES AND ORTHOGONAL TRNAS ACIB GMBH - AUSTRIAN CENTRE OF INDUSTRIAL BIOTECHNOLOGY (AT) 2018-10-11 WO disclosed