SCHEMBL5408533

SCHEMBL5408533

[AlH3].c1ccc(Oc2ccnc(Oc3ccccc3)c2Oc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 3/20 0.44
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
LTA4H P09960 2/20 0.39
TSHR P16473 1/20 0.39
HTR1A P08908 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
NPC1 O15118 1/20 0.37
CRHBP P24387 1/20 0.37

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
SCHEMBL4891532 0.98 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL1078325 0.83 LTA4H (0.49) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL10666285 0.78 KMT2A (0.45) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL10666290 0.78 PTGS1 (0.42) KMT2AMAPTHPGDKDM4EGLA
SCHEMBL31585880 0.76 KMT2A (0.41) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL8529216 0.75 MEN1 (0.46) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL4938450 0.75 TDP1 (0.51) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2
SCHEMBL9780873 0.71 LTA4H (0.55) ALDH1A1KMT2AL3MBTL1MAPTHPGD
SCHEMBL19205830 0.71 LTA4H (0.55) ALDH1A1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL9514665 0.70 KMT2A (0.40) ALDH1A1KMT2AMEN1L3MBTL1CYP1A2

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
US-7198859-B2 Materials and structures for enhancing the performance of organic light emitting devices UNIVERSAL DISPLAY CORPORATION (US) 2007-04-03 US disclosed
US-20050019605-A1 Materials and structures for enhancing the performance of organic light emitting devices UNIVERSAL DISPLAY CORPORATION 2005-01-27 US disclosed