SCHEMBL28336702

SCHEMBL28336702

CCOc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.61
NQO1 P15559 1/20 0.58
LMNA P02545 1/20 0.57
MAPK1 P28482 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
PARP10 Q53GL7 1/20 0.55
RELA Q04206 1/20 0.55
PRSS1 P07477 1/20 0.55
PRSS2 P07478 1/20 0.55
PRSS3 P35030 1/20 0.55
ESR1 P03372 4/20 0.54
CYP19A1 P11511 2/20 0.54
ESR2 Q92731 2/20 0.54
NPC1 O15118 4/20 0.54
MAPT P10636 3/20 0.54
RAB9A P51151 3/20 0.54
CYP3A4 P08684 2/20 0.54
KMT2A Q03164 2/20 0.54
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54

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
SCHEMBL13120633 0.93 CES2 (0.55) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL4363576 0.88 LTA4H (0.61) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL4366695 0.88 LTA4H (0.61) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL19506967 0.87 ESR1 (0.67) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL31163188 0.87 LTA4H (0.52) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL15101927 0.84 LTA4H (0.63) LTA4HESR1CYP19A1ESR2NPC1
SCHEMBL460957 0.84 CES2 (0.63) LTA4HLMNAMAPK1L3MBTL1PARP10
SCHEMBL845256 0.84 L3MBTL1 (0.77) LMNAMAPK1L3MBTL1PARP10NPC1
SCHEMBL19220415 0.84 LTA4H (0.57) LTA4HNQO1LMNAMAPK1L3MBTL1
SCHEMBL9405335 0.82 LTA4H (0.55) LTA4HNQO1LMNAMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110551263-A multi-block polymer, synthesis method thereof and fluorescent probe for tumor detection UNIV SOUTH CHINA NORMAL 2019-12-10 CN claimed
CN-110551263-B Multi-block polymer, synthesis method thereof and fluorescent probe for tumor detection 华南师范大学 2021-09-24 CN disclosed
CN-110551263-A multi-block polymer, synthesis method thereof and fluorescent probe for tumor detection UNIV SOUTH CHINA NORMAL 2019-12-10 CN disclosed