SCHEMBL4409239

SCHEMBL4409239

CCCCCn1nnnc1CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.39
CNR2 P34972 2/20 0.36
CNR1 P21554 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
HTT P42858 2/20 0.35
CYP2C19 P33261 1/20 0.34
LMNA P02545 2/20 0.33
HCAR3 P49019 1/20 0.33

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
SCHEMBL4405900 0.98 SLC9A1 (0.41) SLC9A1CNR2CNR1KMT2AMEN1
SCHEMBL4406692 0.95 KMT2A (0.40) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4403800 0.87 ALDH1A1 (0.41) SLC9A1CNR2KMT2AMEN1CYP2C19
SCHEMBL2051081 0.83 SLC9A1 (0.42) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4405197 0.83 SLC9A1 (0.42) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4410772 0.81 SLC9A1 (0.41) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4405575 0.81 SLC9A1 (0.41) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4403827 0.81 SLC9A1 (0.41) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4406845 0.81 SLC9A1 (0.44) SLC9A1KMT2AMEN1HTTCYP2C19
SCHEMBL4407183 0.80 SLC9A1 (0.42) SLC9A1KMT2AMEN1HTTCYP2C19

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