SCHEMBL30057731

SCHEMBL30057731

COc1cccc(C(O)c2cc(OC)ccc2Br)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
PKM P14618 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
CASR P41180 1/20 0.41
LMNA P02545 1/20 0.40
BRD4 O60885 1/20 0.40
ADRA2A P08913 2/20 0.40
ADRA1A P35348 2/20 0.40
KDM4A O75164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL6866452 0.88 AOC3 (0.47) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL23457049 0.85 ADRA2A (0.47) LMNAADRA2AADRA1ANPC1RAB9A
SCHEMBL31682604 0.85 ADRA2A (0.47) LMNAADRA2AADRA1ANPC1RAB9A
SCHEMBL20157583 0.81 LMNA (0.46) LMNABRD4ADRA2AADRA1ATSHR
SCHEMBL30438867 0.81 AOC3 (0.47) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL2093768 0.81 AOC3 (0.59) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL20157585 0.80 LMNA (0.45) LMNAADRA2AADRA1AMAPK1CYP2D6
SCHEMBL18113374 0.80 LMNA (0.45) LMNAADRA2AADRA1AMAPK1CYP2D6
SCHEMBL18529828 0.79 AOC3 (0.50) AOC3L3MBTL1PKMCHRM2CHRM1
SCHEMBL31476413 0.79 AOC3 (0.50) AOC3L3MBTL1PKMCHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116120759-A Method for synthesizing anthracene fluorescent dye 岱纳科技(北京)有限公司 2023-05-16 CN disclosed
CN-112300599-B Hydrophilic anthracene fluorescent dye and synthetic method thereof 赛纳生物科技(北京)有限公司 2023-01-03 CN disclosed