SCHEMBL31497307

SCHEMBL31497307

OB(O)Oc1ccc(-c2cccc3ccccc23)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
GAA P10253 2/20 0.37
HSD17B10 Q99714 2/20 0.37
PGR P06401 1/20 0.37
PTGS1 P23219 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2A6 P11509 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
SLC6A9 P48067 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
SCHEMBL30390176 0.87 ALDH1A1 (0.41) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL30010651 0.83 MAPT (0.44) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL1208635 0.83 ALDH1A1 (0.50) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL29405949 0.83 ALDH1A1 (0.50) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL28694633 0.81 ALDH1A1 (0.49) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL28698285 0.81 ALDH1A1 (0.49) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL4918884 0.81 ALDH1A1 (0.49) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL30960875 0.80 HPRT1 (0.52) ALDH1A1GAAHSD17B10PGRPTGS1
SCHEMBL1208501 0.80 CRHBP (0.46) ALDH1A1HSD17B10MAPK1KMT2AMEN1
SCHEMBL7611626 0.80 HPRT1 (0.52) ALDH1A1GAAHSD17B10PGRPTGS1

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-119798594-A Organic room-temperature phosphorescent material and preparation method and application thereof 厦门大学 2025-04-11 CN disclosed