SCHEMBL8038155

SCHEMBL8038155

CC(C)(C)c1cc(CCCCC(=O)O)cc(-n2nc3ccccc3n2)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.43
MAOA P21397 2/20 0.43
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
GAA P10253 5/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ACHE P22303 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
AGTR1 P30556 1/20 0.39
HTT P42858 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HDAC3 O15379 1/20 0.38
MAPK1 P28482 1/20 0.38
ADRA1A P35348 1/20 0.38
HDAC4 P56524 1/20 0.38
SLC6A3 Q01959 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
SCHEMBL466180 0.97 MAOB (0.44) MAOBMAOAMAPTRXFP1GAA
SCHEMBL100766 0.92 MAOB (0.45) MAOBMAOAGAAMEN1KMT2A
SCHEMBL29768287 0.92 MAOB (0.45) MAOBMAOAGAAMEN1KMT2A
1,6-Hexanediol SCHEMBL4254054 0.88 MAOB (0.41) MAOBMAOAMAPTGAAMEN1
SCHEMBL6516967 0.86 NPC1 (0.41) MAOBMAOAMAPTGAAMEN1
SCHEMBL15400149 0.85 MAOB (0.41) MAOBMAOAGAAMEN1KMT2A
SCHEMBL5711711 0.85 MAOB (0.39) MAOBMAOAGAAKMT2AACHE
SCHEMBL7593809 0.85 MAOB (0.45) MAOBMAOAGAAMEN1KMT2A
SCHEMBL8773778 0.85 NPC1 (0.40) MAPTGAAKMT2AACHEALDH1A1
SCHEMBL10135977 0.85 GAA (0.44) MAOBMAOAGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718341-B1 High molecular weight stabilizer compounds for stabilizing polymers GEN ELECTRIC (US) 2000-03-15 EP disclosed
US-5962558-A RADIATION RESISTANCE GENERAL ELECTRIC COMPANY (US) 1999-10-05 US disclosed
US-5919891-A AROMATIC POLYCARBONATE ENDCAPPED WITH 3-(2H-BENZOTRIAZOL-2-YL)-5-(1,1-DIMETHYLETHYL)-4-HYDROXY-BENZE NE-PROPANOIC ACID; IMPROVED RESISTANCE TO THE EFFECTS OF ULTRAVIOLET RADIATION GENERAL ELECTRIC COMPANY (US) 1999-07-06 US disclosed
US-5900487-A ESTER OF 3-(2H-BENZOTRIAZOL-2-TL)-5-(1,1-DIMETHYLETHYL)-4-HYDROXY BENZENEPROPANOIC ACID GENERAL ELECTRIC COMPANY (US) 1999-05-04 US disclosed
US-5807963-A RADIATION RESISTANT GENERAL ELECTRIC COMPANY (US) 1998-09-15 US disclosed
EP-0718341-A2 High molecular weight stabilizer compounds for stabilizing polymers GENERAL ELECTRIC COMPANY (US) 1996-06-26 EP disclosed
US-5523379-A MODIFYING A POLYCARBONATE WITH A BENZOTRIAZOLE DERIVATIVE TO IMPART IMPROVED RESISTANCE TO EFFECTS OF ULTRAVIOLET RADIATION GENERAL ELECTRIC PLASTICS (US) 1996-06-04 US disclosed