SCHEMBL28858429

SCHEMBL28858429

Nc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.42
PNMT P11086 1/20 0.41
AR P10275 6/20 0.40
PGR P06401 2/20 0.38
BACE1 P56817 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
HTR7 P34969 2/20 0.35
FFAR4 Q5NUL3 1/20 0.35
HTR2B P41595 1/20 0.35
SCN9A Q15858 1/20 0.34
ALOX5AP P20292 1/20 0.34

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
SCHEMBL28760155 0.84 AR (0.41) ACHEPNMTARPGRNPC1
SCHEMBL27919002 0.83 AR (0.47) ACHEPNMTARPGRNPC1
SCHEMBL7805125 0.82 PNMT (0.47) ACHEPNMTPGRNPC1RAB9A
SCHEMBL18335236 0.81 PNMT (0.44) ACHEPNMTNPC1RAB9AKDM4E
SCHEMBL28454001 0.78 PNMT (0.47) ACHEPNMTNPC1RAB9AKDM4E
SCHEMBL20340068 0.78 ALDH1A1 (0.46) ACHEPNMTNPC1RAB9AKDM4E
SCHEMBL21385041 0.78 PNMT (0.44) ACHEPNMTPGRNPC1RAB9A
SCHEMBL20640732 0.78 PNMT (0.44) ACHEPNMTNPC1RAB9AKDM4E
SCHEMBL5679834 0.78 ALDH1A1 (0.47) ACHEPNMTPGRNPC1RAB9A
SCHEMBL28860542 0.78 PNMT (0.44) ACHEPNMTBACE1NPC1RAB9A

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-118005921-A High-transparency polyimide film material for flexible display and preparation method thereof 大连理工大学盘锦产业技术研究院 2024-05-10 CN claimed
CN-105273189-B Transparent polyimide film and its preparation and application with barrier action of ultraviolet radiation 武汉依麦德新材料科技有限责任公司 2018-05-04 CN disclosed