SCHEMBL23926519

SCHEMBL23926519

C=CC(=O)O[C@@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
HCAR2 Q8TDS4 1/20 0.47
LMNA P02545 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TGM2 P21980 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
CTSB P07858 2/20 0.43
CA12 O43570 1/20 0.42
AKR1B10 O60218 1/20 0.42
AKR1B1 P15121 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 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
SCHEMBL15841013 1.00 ALDH1A1 (0.49) ALDH1A1HCAR2LMNAL3MBTL1TGM2
SCHEMBL18631708 0.86 ALDH1A1 (0.50) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL18631657 0.84 ALDH1A1 (0.47) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL20511576 0.84 ALDH1A1 (0.47) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL18631654 0.84 ALDH1A1 (0.47) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL23926526 0.82 ALDH1A1 (0.43) ALDH1A1HCAR2LMNAL3MBTL1TGM2
SCHEMBL14340455 0.81 ALDH1A1 (0.43) ALDH1A1HCAR2LMNAL3MBTL1TGM2
SCHEMBL18631638 0.81 ALDH1A1 (0.65) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL18631637 0.81 ALDH1A1 (0.65) ALDH1A1HCAR2LMNAL3MBTL1TDP1
SCHEMBL19245074 0.81 ALDH1A1 (0.65) ALDH1A1HCAR2LMNAL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112771088-B Acrylate copolymers for galenic applications 美因茨约翰内斯古藤贝格大学 2022-10-25 CN disclosed
EP-3898732-A1 ACRYLATE COPOLYMERS FOR GALENIC APPLICATIONS Johannes Gutenberg-Universität Mainz (DE) 2021-10-27 EP disclosed