SCHEMBL24464141

SCHEMBL24464141

CC(O)CN(CC(C)O)C(C)C(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TDP1 Q9NUW8 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
CTSB P07858 4/20 0.44
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
CTSL P07711 2/20 0.43
CTSS P25774 2/20 0.43
CTSK P43235 2/20 0.43
ATM Q13315 2/20 0.43
TSHR P16473 1/20 0.42
KDM4E B2RXH2 2/20 0.42
ELANE P08246 1/20 0.42

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
SCHEMBL9841010 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL9841014 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL26988864 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1404478 0.83 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL24514516 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL26290931 0.80 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL18510056 0.80 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL10493728 0.80 ALDH1A1 (0.60) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL7429091 0.80 ALDH1A1 (0.60) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2
SCHEMBL1107604 0.78 ALDH1A1 (0.62) ALDH1A1MAPK1L3MBTL1TDP1SLC6A2

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
EP-3587409-B1 BIODEGRADABLE LIPIDS FOR DELIVERY OF NUCLEIC ACIDS TRANSLATE BIO INC (US) 2022-06-01 EP disclosed