SCHEMBL5283922

SCHEMBL5283922

CCCCc1[nH]nnc1CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.40
HCAR3 P49019 1/20 0.34
GAA P10253 2/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PBRM1 Q86U86 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
SCHEMBL5284627 0.89 HCAR3 (0.31) HCAR2HCAR3
SCHEMBL5276698 0.84 HCAR2 (0.44) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL5279145 0.82 HCAR2 (0.42) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL5276881 0.82 HCAR2 (0.42) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL5278359 0.80 HCAR3 (0.33) HCAR2HCAR3
SCHEMBL5285125 0.79 POLB (0.30) HCAR2HCAR3GAA
SCHEMBL460418 0.79 MEN1 (0.41) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL5274721 0.79 HCAR2 (0.39) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL11318964 0.77 MEN1 (0.40) HCAR2HCAR3GAATSHRMAPK1
SCHEMBL19501783 0.77 HCAR2 (0.38) HCAR2HCAR3MAPT

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