SCHEMBL22232689

SCHEMBL22232689

O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cn1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 1/20 0.70
▸ MEN1 O00255 6/20 0.59
▸ KMT2A Q03164 6/20 0.59
▸ POLB P06746 5/20 0.58
▸ NPC1 O15118 3/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ MITF O75030 2/20 0.58
▸ KDR P35968 2/20 0.56
▸ MAPT P10636 6/20 0.55
▸ MAPK1 P28482 2/20 0.54
▸ CYP1A2 P05177 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ TGM2 P21980 1/20 0.51
▸ PABPC1 P11940 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ NAMPT P43490 1/20 0.50

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
SCHEMBL29151290 0.92 P4HTM (0.61) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL25383579 0.91 P4HTM (0.60) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL13428717 0.87 P4HTM (0.56) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL30354784 0.87 NPC1 (0.62) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL29151218 0.86 P4HTM (0.54) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL29151332 0.86 P4HTM (0.54) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL29151306 0.85 RAB9A (0.68) P4HTMMEN1KMT2APOLBNPC1
SCHEMBL22232691 0.84 GAA (0.69) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30485792 0.84 GAA (0.69) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL31277910 0.83 P4HTM (0.58) P4HTMMEN1KMT2APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868211-B Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film, and liquid crystal display using the same 株式会社LG化学 2023-07-07 — — CN disclosed
US-11667843-B2 Liquid crystal alignment agent composition, method of preparing liquid crystal alignment film, and liquid crystal alignment film, and liquid crystal display using the same LG CHEM, LTD. (KR) 2023-06-06 — — US disclosed
US-11667843-B2 Liquid crystal alignment agent composition, method of preparing liquid crystal alignment film, and liquid crystal alignment film, and liquid crystal display using the same LG CHEM, LTD. (KR) 2023-06-06 — — US disclosed
US-20210139782-A1 LIQUID CRYSTAL ALIGNMENT AGENT COMPOSITION, METHOD OF PREPARING LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY USING THE SAME LG CHEM, LTD. (KR) 2021-05-13 — — US disclosed
CN-111868211-A Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film, and liquid crystal alignment film, liquid crystal display using the same 株式会社LG化学 2020-10-30 — — CN disclosed
WO-2020149574-A1 LIQUID CRYSTAL ALIGNMENT COMPOSITION, METHOD OF PREPARING LIQUID CRYSTAL ALIGNMENT FILM USING SAME, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY USING SAME 주식회사 엘지화학 2020-07-23 — — WO disclosed
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