SCHEMBL4407183

SCHEMBL4407183

CCCCCCn1nnnc1CCCCC

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.42
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.36
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL4414808 1.00 SLC9A1 (0.42) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4409237 1.00 SLC9A1 (0.42) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4405575 0.98 SLC9A1 (0.41) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4408311 0.96 MEN1 (0.40) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4403652 0.96 SLC9A1 (0.42) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4414852 0.94 KMT2A (0.41) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4403827 0.94 SLC9A1 (0.41) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL4409040 0.93 CYP1A2 (0.39) SLC9A1MEN1KMT2ACYP2C19ALDH1A1
SCHEMBL4413951 0.93 SLC9A1 (0.42) SLC9A1MEN1KMT2AHTTCYP2C19
SCHEMBL97712 0.92 SLC9A1 (0.38) SLC9A1MEN1KMT2AHTTCYP2C19

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