SCHEMBL4412072

SCHEMBL4412072

CC(C)(C)Cn1nnnc1F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL4415158 0.75 LMNA (0.31) LMNAKMT2A
SCHEMBL4403602 0.75
SCHEMBL4405424 0.74 LMNA (0.33) LMNAKMT2AALDH1A1
SCHEMBL4405008 0.74 LMNA (0.33) LMNAKMT2AALDH1A1
SCHEMBL4412055 0.74 LMNA (0.33) LMNAKMT2AALDH1A1
SCHEMBL4409305 0.74 LMNA (0.31) LMNAKMT2A
SCHEMBL4413974 0.71
SCHEMBL4411106 0.71 LMNA (0.31) LMNAKMT2AALDH1A1
SCHEMBL4397487 0.71 LMNA (0.31) LMNAKMT2A
SCHEMBL4405543 0.70 CNR2 (0.41) LMNAKMT2AALDH1A1

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