SCHEMBL4404929

SCHEMBL4404929

CCCCCCn1nnc(C(F)(F)F)n1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.40
KMT2A Q03164 1/20 0.37
TLR8 Q9NR97 1/20 0.37
DDX3X O00571 1/20 0.36

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
SCHEMBL4405766 0.98 TRPV1 (0.38) TRPV1KMT2ATLR8DDX3X
SCHEMBL4407810 0.93 DDX3X (0.39) KMT2ADDX3X
SCHEMBL4403696 0.87 TRPV1 (0.39) TRPV1KMT2A
SCHEMBL4407390 0.85 RECQL (0.39) KMT2A
SCHEMBL4405696 0.85 TRPV1 (0.36) TRPV1KMT2ATLR8DDX3X
SCHEMBL4415113 0.83 TRPV1 (0.40) TRPV1KMT2A
SCHEMBL4405805 0.82 TRPV1 (0.39) TRPV1KMT2A
SCHEMBL4408451 0.81 TRPV1 (0.38) TRPV1KMT2A
SCHEMBL4405641 0.80 TRPV1 (0.39) TRPV1KMT2A
SCHEMBL4407458 0.79 DDX3X (0.36) TRPV1KMT2ADDX3X

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