SCHEMBL25557002

SCHEMBL25557002

O=C1OC(=O)c2cc(N3CCN(c4ccc5c(c4)C(=O)OC5=O)CC3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 3/20 0.49
ALOX15 P16050 2/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TDP1 Q9NUW8 1/20 0.44
PSMD14 O00487 1/20 0.41
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KIF11 P52732 2/20 0.39
HTR3A P46098 1/20 0.38
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 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
SCHEMBL10689686 0.94 ALDH1A1 (0.56) ALDH1A1HSD17B10ALOX15MAPTMEN1
SCHEMBL10688892 0.92 ALDH1A1 (0.54) ALDH1A1HSD17B10ALOX15MAPTMEN1
SCHEMBL26761798 0.90 ALDH1A1 (0.41) ALDH1A1HSD17B10ALOX15MAPTMEN1
SCHEMBL11517116 0.77 L3MBTL1 (0.49) ALDH1A1HSD17B10ALOX15MEN1KMT2A
SCHEMBL6252262 0.74 MGLL (0.55) ALDH1A1TDP1
SCHEMBL11517898 0.74 KMT2A (0.49) ALDH1A1ALOX15MAPTMEN1KMT2A
SCHEMBL10934428 0.72 PARP1 (0.46) ALDH1A1HSD17B10ALOX15MEN1KMT2A
SCHEMBL9512923 0.71 ALDH1A1 (0.61) ALDH1A1HSD17B10ALOX15MAPTMEN1
SCHEMBL29204334 0.71 ALDH1A1 (0.61) ALDH1A1HSD17B10ALOX15MAPTMEN1
SCHEMBL14983932 0.71 ALDH1A1 (0.56) ALDH1A1HSD17B10ALOX15MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807794-B2 Liquid crystal alignment agent and preparation method thereof, liquid crystal alignment film and preparation method thereof, and liquid crystal cell SHENZHEN DALTON ELECTRONIC MATERIAL CO., LTD (CN) 2023-11-07 US disclosed
US-11807794-B2 Liquid crystal alignment agent and preparation method thereof, liquid crystal alignment film and preparation method thereof, and liquid crystal cell SHENZHEN DALTON ELECTRONIC MATERIAL CO., LTD (CN) 2023-11-07 US disclosed
US-20230167365-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND PREPARATION METHOD THEREOF, LIQUID CRYSTAL ALIGNMENT FILM AND PREPARATION METHOD THEREOF, AND LIQUID CRYSTAL CELL SHENZHEN DALTON ELECTRONIC MATERIAL CO., LTD (CN) 2023-06-01 US disclosed
US-20230167365-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND PREPARATION METHOD THEREOF, LIQUID CRYSTAL ALIGNMENT FILM AND PREPARATION METHOD THEREOF, AND LIQUID CRYSTAL CELL SHENZHEN DALTON ELECTRONIC MATERIAL CO., LTD (CN) 2023-06-01 US disclosed