SCHEMBL22355225

SCHEMBL22355225

CC(=O)NCC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
P2RY12 Q9H244 1/20 0.32
CTSK P43235 2/20 0.32
CYP2D6 P10635 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
NOD2 Q9HC29 1/20 0.31
CAPN1 P07384 1/20 0.31
F2 P00734 1/20 0.30

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
SCHEMBL22355198 1.00 L3MBTL1 (0.39) L3MBTL1KMT2APOLBP2RY12CTSK
SCHEMBL20885316 0.84 L3MBTL1 (0.38) L3MBTL1KMT2APOLBMAPTF2
SCHEMBL22355188 0.83 FOLH1 (0.42) L3MBTL1KMT2APOLB
SCHEMBL22355213 0.79 L3MBTL1 (0.34) L3MBTL1KMT2APOLBF2
SCHEMBL22355305 0.78 CTSK (0.34) L3MBTL1KMT2APOLBP2RY12CTSK
SCHEMBL22355235 0.77 MEN1 (0.53) KMT2ACYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL18082022 0.76 KMT2A (0.46) L3MBTL1KMT2APOLBP2RY12CTSK
SCHEMBL30185966 0.75 FOLH1 (0.47) KMT2APOLBTDP1MAPT
SCHEMBL14720047 0.75 L3MBTL1 (0.57) L3MBTL1KMT2APOLBP2RY12CTSK
Hydrochloric Acid SCHEMBL9088394 0.75 L3MBTL1 (0.39) L3MBTL1KMT2APOLBTDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020167831-A1 METHOD OF PREPARING A DON PRODRUG FROM L-GLUTAMIC ACID DRACEN PHARMACEUTICALS, INC. (US) 2020-08-20 WO disclosed