SCHEMBL28293490

SCHEMBL28293490

COC(=O)CCCc1ccc2c(c1CCCC(=O)OC)Cc1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
PTPRC P08575 4/20 0.42
PTPN13 Q12923 1/20 0.41
CYP1A2 P05177 1/20 0.40
ADRA2A P08913 1/20 0.40
MAOA P21397 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2C P28335 1/20 0.40
SLC6A4 P31645 1/20 0.40
HTR2B P41595 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 2/20 0.39
PNMT P11086 1/20 0.38

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
SCHEMBL28956893 0.91 RAB9A (0.47) RAB9ANPC1PTPRCPTPN13CYP1A2
SCHEMBL28293487 0.83 RAB9A (0.46) RAB9ANPC1CYP1A2ADRA2AMAOA
SCHEMBL2672468 0.81 PNMT (0.44) RAB9ANPC1CYP1A2ADRA2AMAOA
SCHEMBL28300195 0.81 MAPT (0.45) RAB9ANPC1MAPTMAPK1PNMT
SCHEMBL3425445 0.80 PNMT (0.43) RAB9ANPC1CYP1A2ALDH1A1PNMT
SCHEMBL235556 0.79 PNMT (0.42) RAB9ANPC1CYP1A2ALDH1A1PNMT
SCHEMBL6759460 0.79 PNMT (0.42) RAB9ANPC1CYP1A2ALDH1A1PNMT
SCHEMBL6758782 0.79 PNMT (0.42) RAB9ANPC1CYP1A2ALDH1A1PNMT
SCHEMBL21811871 0.79 PNMT (0.53) RAB9ANPC1PTPRCPTPN13CYP1A2
SCHEMBL31711756 0.79 PNMT (0.42) RAB9ANPC1CYP1A2ALDH1A1PNMT

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-109791224-A Optics polyester film and transparent and electrically conductive film 三菱瓦斯化学株式会社 2019-05-21 CN disclosed
CN-109790283-A Copolymer polyester resin 三菱瓦斯化学株式会社 2019-05-21 CN disclosed
CN-109642962-A Optical lens 三菱瓦斯化学株式会社 2019-04-16 CN disclosed