SCHEMBL4414617

SCHEMBL4414617

CCCCc1nnn(Br)n1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4416343 0.94 MIF (0.35) ALDH1A1
SCHEMBL4410978 0.92 ALDH1A1 (0.34) ALDH1A1
SCHEMBL4409297 0.87
SCHEMBL4409262 0.78 POLB (0.41) SIRT1ALDH1A1
SCHEMBL4415070 0.78
SCHEMBL4408760 0.75 LMNA (0.38)
SCHEMBL4413441 0.75 SIRT1 (0.32) SIRT1ALDH1A1
SCHEMBL4407812 0.75 SIRT1 (0.32) SIRT1ALDH1A1
SCHEMBL4412152 0.73 KMT2A (0.45) ALDH1A1
SCHEMBL4409043 0.73 KMT2A (0.38)

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
EP-1859782-B1 Composition for coloring and/or lightening human hair comprising tetrazoles HENKEL AG & CO KGAA (DE) 2009-12-30 EP disclosed
EP-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed