SCHEMBL29610262

SCHEMBL29610262

c1ccc(C(=C(c2ccccc2)c2nc3ccccc3o2)c2nc3ccccc3o2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.52
RAB9A P51151 7/20 0.47
NPC1 O15118 6/20 0.47
GAA P10253 3/20 0.47
FAAH O00519 2/20 0.47
CES1 P23141 1/20 0.47
DAGLA Q9Y4D2 1/20 0.47
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 4/20 0.46
SCD O00767 1/20 0.45
KDM4E B2RXH2 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.44
PKM P14618 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 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
SCHEMBL250149 1.00 XDH (0.52) XDHRAB9ANPC1GAAFAAH
SCHEMBL3213370 0.98 XDH (0.51) XDHRAB9ANPC1GAAFAAH
SCHEMBL28082044 0.94 XDH (0.51) XDHRAB9ANPC1GAAFAAH
SCHEMBL6688216 0.85 XDH (0.51) XDHRAB9ANPC1GAAFAAH
SCHEMBL27909818 0.81 SCD (0.57) XDHRAB9ANPC1GAAFAAH
SCHEMBL12545534 0.81 XDH (0.50) XDHRAB9ANPC1GAAFAAH
SCHEMBL8032979 0.80 XDH (0.54) XDHRAB9ANPC1GAAFAAH
SCHEMBL447888 0.80 XDH (0.58) XDHRAB9ANPC1GAAHPGD
SCHEMBL31032654 0.80 XDH (0.58) XDHRAB9ANPC1GAAHPGD
SCHEMBL1590095 0.78 FAAH (0.55) XDHRAB9ANPC1GAAFAAH

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-116535736-A Anti-aging agent composition, application thereof and polyurethane chest cotton comprising anti-aging agent composition 天津利安隆新材料股份有限公司 2023-08-04 CN claimed
CN-115505220-B Resin composition, multilayer structure, light conversion film, and agricultural film 苏州睿尔思科技有限公司 2024-11-22 CN disclosed
CN-116535736-A Anti-aging agent composition, application thereof and polyurethane chest cotton comprising anti-aging agent composition 天津利安隆新材料股份有限公司 2023-08-04 CN disclosed
CN-115958821-A Bonding material and method for producing molded body 精工爱普生株式会社 2023-04-14 CN disclosed
CN-110603299-B MILK LUMILUX Dispersion 霍尼韦尔国际公司 2022-05-10 CN disclosed