SCHEMBL28397117

SCHEMBL28397117

O=C(Cl)c1ccc2c(c1)C(=O)c1cc(C(=O)Cl)ccc1C2=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.59
PTPRC P08575 3/20 0.52
TERT O14746 2/20 0.49
ESR1 P03372 1/20 0.48
MAOA P21397 1/20 0.48
UGT1A1 P22309 1/20 0.48
MAOB P27338 1/20 0.48
ESR2 Q92731 1/20 0.48
HTR7 P34969 1/20 0.47
HTR2B P41595 1/20 0.47
S100A4 P26447 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
CDC25A P30304 1/20 0.43

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
SCHEMBL28399814 1.00 TTR (0.59) TTRPTPRCTERTESR1MAOA
SCHEMBL11733475 0.95 TTR (0.53) TTRPTPRCTERTESR1MAOA
SCHEMBL698020 0.94 TTR (0.69) TTRPTPRCHTR7HTR2BS100A4
SCHEMBL3300661 0.92 TTR (0.67) TTRPTPRCHTR7HTR2BS100A4
SCHEMBL7551130 0.88 PTPRC (0.65) TTRPTPRCHTR7HTR2BS100A4
SCHEMBL8954231 0.86 ELANE (0.55) TTRPTPRCTERTMAOAMAOB
SCHEMBL6925901 0.83 PTPRC (0.47) TTRPTPRCHTR7HTR2BS100A4
SCHEMBL5667639 0.83 PTPRC (0.47) TTRPTPRCHTR7HTR2BS100A4
SCHEMBL28438378 0.79 NPC1 (0.53) TTRMAOAMAOBHTR7HTR2B
SCHEMBL28432070 0.79 NPC1 (0.49) TTRPTPRCMAOAHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111040159-A High-barrier polyimide containing high-planarity structure and preparation method and application thereof 湖南工业大学 2020-04-21 CN disclosed