SCHEMBL5285023

SCHEMBL5285023

CC(C)Cc1nn[nH]c1CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.33
HIF1A Q16665 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL5272920 0.87 HCAR3 (0.33) TSHRGAAHIF1ASMN1; SMN2
SCHEMBL5324148 0.87 TSHR (0.31) TSHR
SCHEMBL5279238 0.84 POLB (0.30) GAA
SCHEMBL5280448 0.84
SCHEMBL5279745 0.84 HCAR3 (0.30)
SCHEMBL5274169 0.82
SCHEMBL5283882 0.81 HCAR2 (0.36) TSHRGAA
SCHEMBL5345202 0.77 TSHR (0.33) TSHR
SCHEMBL5323949 0.76 TSHR (0.36) TSHR
SCHEMBL5278220 0.76 TSHR (0.32) 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