SCHEMBL28299701

SCHEMBL28299701

ClCC(Cl)c1c2ccccc2cc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
HTR2A P28223 1/20 0.42
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 4/20 0.38
HIF1A Q16665 1/20 0.38
CYP1B1 Q16678 1/20 0.38
CYP1A2 P05177 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
CYP2C19 P33261 1/20 0.36
CYP3A4 P08684 1/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35
MAOA P21397 1/20 0.35
ACHE P22303 1/20 0.35
AHR P35869 1/20 0.35
TRPM4 Q8TD43 1/20 0.34

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
SCHEMBL4645977 0.78 L3MBTL1 (0.48) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL29853736 0.74 L3MBTL1 (0.45) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL4645643 0.74 L3MBTL1 (0.45) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL12880578 0.72 L3MBTL1 (0.43) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL27809331 0.71 L3MBTL1 (0.42) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL30350011 0.69 L3MBTL1 (1.00) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL592824 0.69 L3MBTL1 (1.00) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL23391018 0.69 ALDH1A1 (0.44) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL488964 0.69 ALDH1A1 (0.46) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A
SCHEMBL40806 0.69 ALDH1A1 (0.44) L3MBTL1HTR2AALDH1A1HSD17B10HIF1A

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-109721721-A A kind of polyethers and its synthetic method and application with photoluminescent property 万华化学集团股份有限公司 2019-05-07 CN disclosed