SCHEMBL10499321

SCHEMBL10499321

N#CCCCCCCNc1ccc(O)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 5/20 0.34
▸ HSP90AA1 P07900 2/20 0.32
▸ HSP90AB1 P08238 2/20 0.32
▸ NAAA Q02083 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
SCHEMBL10499067 0.84 HTT (0.39) —
SCHEMBL10500144 0.84 AR (0.35) PRSS1HSP90AA1HSP90AB1
Hydrochloric Acid SCHEMBL10498922 0.82 HTT (0.38) PRSS1
Hydrochloric Acid SCHEMBL10499227 0.82 PRSS1 (0.35) PRSS1HSP90AA1HSP90AB1
SCHEMBL10499480 0.80 HSP90AA1 (0.32) PRSS1HSP90AA1HSP90AB1NAAA
SCHEMBL10498867 0.76 GAA (0.45) PRSS1
SCHEMBL10499055 0.76 GAA (0.45) PRSS1
SCHEMBL10499081 0.76 GAA (0.45) PRSS1
SCHEMBL10499063 0.76 GAA (0.45) PRSS1
SCHEMBL10499416 0.74 GAA (0.46) PRSS1HSP90AA1HSP90AB1

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
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