SCHEMBL4397510

SCHEMBL4397510

CCCCCc1nnn(CC(C)(C)C)n1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.34
MIF P14174 1/20 0.32
KMT2A Q03164 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
SCHEMBL4404513 0.98 GPR84 (0.33) GPR84
SCHEMBL4408481 0.95 PKM (0.31)
SCHEMBL4407947 0.87 PKM (0.33)
SCHEMBL4411011 0.82 GPR84 (0.38) GPR84MIFKMT2A
SCHEMBL4411053 0.80 KMT2A (0.46) GPR84KMT2A
SCHEMBL4408985 0.80 GPR84 (0.37) GPR84
SCHEMBL4405663 0.80 KMT2A (0.40) KMT2A
SCHEMBL4403847 0.80 TRPV1 (0.40) KMT2A
SCHEMBL4412009 0.80 PKM (0.34)
SCHEMBL4405063 0.79 TRPV1 (0.39) KMT2A

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