SCHEMBL10499360

SCHEMBL10499360

O=C(CCCCCCBr)Nc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.60
HDAC4 P56524 5/20 0.60
PSMB11 A5LHX3 2/20 0.60
PSMA7 O14818 2/20 0.60
PSMB1 P20618 2/20 0.60
PSMA1 P25786 2/20 0.60
PSMA2 P25787 2/20 0.60
PSMA3 P25788 2/20 0.60
PSMA4 P25789 2/20 0.60
PSMB8 P28062 2/20 0.60
PSMB9 P28065 2/20 0.60
PSMA5 P28066 2/20 0.60
PSMB4 P28070 2/20 0.60
PSMB6 P28072 2/20 0.60
PSMB5 P28074 2/20 0.60
PSMB10 P40306 2/20 0.60
PSMB3 P49720 2/20 0.60
PSMB2 P49721 2/20 0.60
PSMA6 P60900 2/20 0.60
PSMA8 Q8TAA3 2/20 0.60

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
SCHEMBL10498915 1.00 GAA (0.60) GAAHDAC4PSMB11PSMA7PSMB1
SCHEMBL10499076 1.00 GAA (0.60) GAAHDAC4PSMB11PSMA7PSMB1
SCHEMBL11249589 1.00 GAA (0.60) GAAHDAC4PSMB11PSMA7PSMB1
SCHEMBL10499219 0.93 CYP1A1 (0.62) GAAHDAC4PSMB11PSMA7PSMB1
SCHEMBL22479429 0.86 MEN1 (0.61) HDAC4HDAC1HDAC6HDAC3HDAC2
SCHEMBL28909121 0.85 CYP1A1 (0.67) GAAHDAC4PSMB11PSMA7PSMB1
SCHEMBL8551297 0.85 HDAC3 (0.73) HDAC4HDAC1HDAC6HDAC3HDAC2
SCHEMBL1561735 0.85 CYP1A2 (0.60) HDAC4HDAC1HDAC6HDAC3HDAC2
SCHEMBL4837637 0.84 HDAC4 (0.72) HDAC4HDAC1HDAC6HDAC3HDAC2
SCHEMBL13529727 0.84 CYP1A1 (0.77) GAAHDAC4PSMB11PSMA7PSMB1

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
US-4835180-A N-(ω-cyanoalkyl)aminophenols and use as inhibitors of lipoxygenase activity STERLING DRUG INC. (US) 1989-05-30 US disclosed
EP-0262618-A2 N-(omega)-cyanoalkyl)aminophenols, and their preparation STERLING DRUG INC. (US) 1988-04-06 EP disclosed