SCHEMBL23926528

SCHEMBL23926528

C=C(C)C(=O)OC(C)C(=O)O.CC=C(C)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
SLC15A1 P46059 2/20 0.39
HCAR2 Q8TDS4 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPK1 P28482 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CTSL P07711 3/20 0.36
CTSB P07858 3/20 0.36
LMNA P02545 3/20 0.36
ATM Q13315 1/20 0.36
CTSS P25774 1/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL23926526 0.86 ALDH1A1 (0.43) ALDH1A1SLC15A1HCAR2L3MBTL1KMT2A
SCHEMBL24179030 0.83 ALDH1A1 (0.53) ALDH1A1SLC15A1HCAR2L3MBTL1KMT2A
SCHEMBL11887998 0.83 ALDH1A1 (0.53) ALDH1A1SLC15A1HCAR2L3MBTL1KMT2A
SCHEMBL873995 0.82 ALDH1A1 (0.63) ALDH1A1HCAR2L3MBTL1KMT2AMAPK1
SCHEMBL4317881 0.82 ALDH1A1 (0.63) ALDH1A1HCAR2L3MBTL1KMT2AMAPK1
SCHEMBL873996 0.82 ALDH1A1 (0.63) ALDH1A1HCAR2L3MBTL1KMT2AMAPK1
Ammonia Solution, Strong SCHEMBL27722063 0.81 ALDH1A1 (0.61) ALDH1A1HCAR2L3MBTL1KMT2AMAPK1
SCHEMBL23926529 0.81 ALDH1A1 (0.47) ALDH1A1SLC15A1HCAR2L3MBTL1KMT2A
SCHEMBL27953370 0.79 ALDH1A1 (0.51) ALDH1A1SLC15A1HCAR2L3MBTL1KMT2A
SCHEMBL28083788 0.78 ALDH1A1 (0.58) ALDH1A1HCAR2L3MBTL1KMT2AMAPK1

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-3898732-A1 ACRYLATE COPOLYMERS FOR GALENIC APPLICATIONS Johannes Gutenberg-Universität Mainz (DE) 2021-10-27 EP disclosed