SCHEMBL21581741

SCHEMBL21581741

O=C(Nc1ccc(NC(=O)N(CCO)CCO)cc1)N(CCO)CCO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ROCK2 O75116 1/20 0.48
ROCK1 Q13464 1/20 0.48
POLB P06746 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 1/20 0.43
HDAC3 O15379 2/20 0.43
HDAC4 P56524 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC7 Q8WUI4 2/20 0.43
HDAC2 Q92769 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC9 Q9UKV0 2/20 0.43
HDAC5 Q9UQL6 2/20 0.43
TSHR P16473 2/20 0.42

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
SCHEMBL22788038 0.91 ROCK2 (0.46) ALDH1A1NPSR1ROCK2ROCK1POLB
SCHEMBL10845515 0.91 POLB (0.53) ALDH1A1POLBSMN1; SMN2NPC1TP53
SCHEMBL6294952 0.90 NPSR1 (0.62) ALDH1A1NPSR1ROCK2ROCK1POLB
SCHEMBL1416197 0.87 POLB (0.43) ALDH1A1NPSR1ROCK2ROCK1POLB
SCHEMBL10843448 0.85 GAA (0.60) ALDH1A1NPSR1POLBSMN1; SMN2NPC1
SCHEMBL10844038 0.83 MAPT (0.66) ALDH1A1POLBSMN1; SMN2NPC1TP53
SCHEMBL6926966 0.83 HDAC3 (0.48) ALDH1A1RAB9AGAAHDAC3HDAC4
SCHEMBL10842245 0.82 APEX1 (0.61) ALDH1A1POLBNPC1RAB9AGAA
SCHEMBL5838386 0.81 RAB9A (0.55) ALDH1A1NPSR1POLBSMN1; SMN2NPC1
SCHEMBL5838457 0.80 NPSR1 (0.59) ALDH1A1NPSR1ROCK2ROCK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475840-B Liquid crystal aligning agent composition, method for producing liquid crystal alignment film, and liquid crystal display device 株式会社LG化学 2023-04-18 CN disclosed
US-11592713-B2 Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film using same, and liquid crystal alignment film and liquid crystal display device using same LG CHEM, LTD. (KR) 2023-02-28 US disclosed
US-11592713-B2 Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film using same, and liquid crystal alignment film and liquid crystal display device using same LG CHEM, LTD. (KR) 2023-02-28 US disclosed
WO-2021112095-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, LIQUID CRYSTAL DISPLAY ELEMENT AND METHOD FOR PRODUCING LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2021-06-10 WO disclosed
EP-3575381-B1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR MANUFACTURING LIQUID CRYSTAL ALIGNING FILM USING SAME, LIQUID CRYSTAL ALIGNING FILM USING SAME, AND LIQUID CRYSTAL DISPLAY DEVICE LG CHEMICAL LTD (KR) 2020-12-30 EP disclosed
US-20200392409-A1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR PREPARING LIQUID CRYSTAL ALIGNMENT FILM USING SAME, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE USING SAME LG CHEM, LTD. (KR) 2020-12-17 US disclosed
US-20200392409-A1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR PREPARING LIQUID CRYSTAL ALIGNMENT FILM USING SAME, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE USING SAME LG CHEM, LTD. (KR) 2020-12-17 US disclosed
EP-3575381-A1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR MANUFACTURING LIQUID CRYSTAL ALIGNING FILM USING SAME, LIQUID CRYSTAL ALIGNING FILM USING SAME, AND LIQUID CRYSTAL DISPLAY DEVICE LG CHEM, LTD. (KR) 2019-12-04 EP disclosed
EP-3575381-A1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR MANUFACTURING LIQUID CRYSTAL ALIGNING FILM USING SAME, LIQUID CRYSTAL ALIGNING FILM USING SAME, AND LIQUID CRYSTAL DISPLAY DEVICE LG CHEM, LTD. (KR) 2019-12-04 EP disclosed