SCHEMBL5284734

SCHEMBL5284734

CCCCn1nnc(F)c1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.43
TOP2A P11388 1/20 0.41
GRM2 Q14416 1/20 0.39
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
HCAR3 P49019 2/20 0.36
TSHR P16473 1/20 0.34
NR1H3 Q13133 1/20 0.33
HTT P42858 2/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
HSD11B1 P28845 1/20 0.32
CYP2C19 P33261 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
SCHEMBL5278936 0.92 SLC9A1 (0.46) SLC9A1TOP2AGRM2HCAR3LMNA
SCHEMBL5283481 0.88 SLC9A1 (0.40) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5276335 0.82 SLC9A1 (0.44) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5277654 0.79 SLC9A1 (0.46) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5276050 0.79
SCHEMBL5284094 0.78 SLC9A1 (0.42) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5277681 0.78 GRM2 (0.45) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5276666 0.78 SLC9A1 (0.42) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5281373 0.77 SLC9A1 (0.41) SLC9A1TOP2AGRM2KMT2AMEN1
SCHEMBL5281499 0.77 SLC9A1 (0.41) SLC9A1TOP2AGRM2KMT2AMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed