SCHEMBL4408295

SCHEMBL4408295

CCCCCn1nnc(F)n1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
MEN1 O00255 1/20 0.39

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
SCHEMBL4404362 0.98 TRPV1 (0.43) KMT2ATRPV1MEN1
SCHEMBL4408118 0.94 KMT2A (0.40) KMT2ATRPV1MEN1
SCHEMBL4407970 0.85
SCHEMBL4397503 0.79 KMT2A (0.41) KMT2ATRPV1MEN1
SCHEMBL4404363 0.78 KMT2A (0.41) KMT2ATRPV1MEN1
SCHEMBL4408850 0.78 KMT2A (0.41) KMT2ATRPV1MEN1
SCHEMBL4411081 0.78 KMT2A (0.41) KMT2ATRPV1MEN1
SCHEMBL4413802 0.78 TRPV1 (0.43) KMT2ATRPV1
SCHEMBL4405766 0.77 TRPV1 (0.38) KMT2ATRPV1MEN1
SCHEMBL8962480 0.76 ALDH1A1 (0.49) KMT2ATRPV1MEN1

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