SCHEMBL21495979

SCHEMBL21495979

Cc1cc(N2C(=O)C=CC2=O)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 14/20 0.53
HSP90AA1 P07900 5/20 0.53
NPSR1 Q6W5P4 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
PKM P14618 1/20 0.53
MAPK1 P28482 1/20 0.53
FAAH O00519 4/20 0.52
CCR6 P51684 1/20 0.48
G6PD P11413 1/20 0.46
TLR9 Q9NR96 1/20 0.46
DDAH1 O94760 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44

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
SCHEMBL30435094 0.82 MGLL (0.59) MGLLHSP90AA1NPSR1PKMMAPK1
SCHEMBL1164427 0.82 MGLL (0.59) MGLLHSP90AA1NPSR1PKMMAPK1
SCHEMBL7922441 0.82 MGLL (0.59) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL29683979 0.82 MGLL (0.59) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL22399177 0.80 MGLL (0.57) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL29898506 0.78 TLR9 (0.61) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL1741609 0.78 TLR9 (0.61) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL14086673 0.78 TSHR (0.44) NPSR1TDP1PKMMAPK1ALDH1A1
SCHEMBL6691307 0.78 HSP90AA1 (0.59) MGLLHSP90AA1NPSR1TDP1PKM
SCHEMBL3180754 0.77 TSHR (0.54) MGLLHSP90AA1NPSR1TDP1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111602087-B Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, polymer and compound JSR株式会社 2023-03-24 CN disclosed
CN-115197719-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, and method for producing same JSR株式会社 2022-10-18 CN disclosed
CN-111602087-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, polymer and compound JSR株式会社 2020-08-28 CN disclosed
WO-2019202884-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, LIQUID CRYSTAL ELEMENT, POLYMER, AND COMPOUND JSR株式会社 2019-10-24 WO disclosed
WO-2019202884-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, LIQUID CRYSTAL ELEMENT, POLYMER, AND COMPOUND JSR株式会社 2019-10-24 WO disclosed