SCHEMBL5324148

SCHEMBL5324148

CCc1nn[nH]c1CC(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
CYP1A2 P05177 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL5285023 0.87 TSHR (0.33) TSHR
SCHEMBL5279238 0.84 POLB (0.30)
SCHEMBL5283882 0.81 HCAR2 (0.36) TSHR
SCHEMBL5280448 0.80
SCHEMBL5274972 0.80
SCHEMBL5279745 0.76 HCAR3 (0.30)
SCHEMBL25413734 0.74
SCHEMBL5279000 0.74 HCAR2 (0.33)
SCHEMBL5345202 0.74 TSHR (0.33) TSHR
SCHEMBL5277207 0.73 HCAR2 (0.39) TSHR

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