SCHEMBL28308306

SCHEMBL28308306

CC(C)c1cc(C(C)C)c2sc3ccccc3c(=O)c2c1.CC(OC(=O)c1ccccc1)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 2/20 0.38
HCRTR1 O43613 1/20 0.38
RXRA P19793 2/20 0.35
RXRB P28702 2/20 0.35
RXRG P48443 2/20 0.35
RARA P10276 1/20 0.34
RAB9A P51151 3/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
Benzophenone SCHEMBL28107994 0.84 MAPT (0.45) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL28308304 0.84 PHLPP2 (0.41) ALDH1A1LMNAMAPTL3MBTL1POLB
Acetophenone SCHEMBL28091583 0.83 MAPT (0.44) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL29352651 0.82 ALDH1A1 (0.50) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL36830 0.82 ALDH1A1 (0.50) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL27729046 0.81 MAPT (0.49) ALDH1A1LMNAMAPTL3MBTL1POLB
Anthraquinone SCHEMBL28090249 0.77 MAPT (0.46) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL6043579 0.73 MAPT (0.40) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL21896337 0.72 MAPT (0.48) ALDH1A1LMNAMAPTL3MBTL1POLB
SCHEMBL65543 0.71 TSHR (0.55) ALDH1A1LMNAMAPTPOLBRAB9A

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
CN-109952535-A Colored photosensitive resin composition, pigment dispersion, partition wall, organic electroluminescent element, image display device, and illumination 三菱化学株式会社 2019-06-28 CN disclosed