SCHEMBL28548681

SCHEMBL28548681

CCC(=O)OCCC(CC)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
F2R P25116 1/20 0.32
CACNA1A O00555 1/20 0.32
CACNA2D1 P54289 1/20 0.32
CACNB1 Q02641 1/20 0.32

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
SCHEMBL25355838 0.92 L3MBTL1 (0.34) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL5711712 0.91 TDP1 (0.33) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL29721220 0.91 TDP1 (0.33) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL31500431 0.90 F2R (0.33) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL29246895 0.83 F2R (0.34) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL20695819 0.82 CNR1 (0.34) ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL27800846 0.81 NPC1 (0.30) NPC1RAB9A
SCHEMBL30254806 0.79 NPC1 (0.38) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL28940118 0.78 NPC1 (0.40) NPC1RAB9AKDM4EALDH1A1MAPT
SCHEMBL7531465 0.77 ALDH1A1 (0.37) NPC1RAB9AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109690395-B Color shift mitigation in electrochromic devices 金泰克斯公司 2021-06-15 CN claimed
CN-112631032-B Composition for forming solution-type electrochromic layer, and electrochromic layer and electrochromic device prepared therefrom 青岛凯欧斯光电科技有限公司 2022-12-09 CN disclosed
CN-112631033-B Composition for forming solution-type electrochromic layer, and electrochromic layer and electrochromic device prepared therefrom 青岛凯欧斯光电科技有限公司 2022-11-01 CN disclosed
CN-108885378-B Flame retardancy of electrochromic devices 金泰克斯公司 2022-08-23 CN disclosed
CN-113711121-A Low dimerization viologen electrochromic compounds and devices 金泰克斯公司 2021-11-26 CN disclosed
CN-109690395-B Color shift mitigation in electrochromic devices 金泰克斯公司 2021-06-15 CN disclosed
CN-112631032-A Composition for forming solution-type electrochromic layer, and electrochromic layer and electrochromic device prepared therefrom 北京开阳亮微科技有限公司 2021-04-09 CN disclosed
CN-112631033-A Composition for forming solution-type electrochromic layer, and electrochromic layer and electrochromic device prepared therefrom 北京开阳亮微科技有限公司 2021-04-09 CN disclosed