SCHEMBL5285420

SCHEMBL5285420

CCCCCCC1(C(F)(F)C(F)(F)F)N=NN=N1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.31
TSHR P16473 1/20 0.31
THRB P10828 1/20 0.31
FAAH O00519 7/20 0.31
CES2 O00748 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 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
SCHEMBL5279541 0.98
SCHEMBL5279412 0.92
SCHEMBL5272722 0.84 TSHR (0.33) CES1TSHRTHRBFAAHCES2
SCHEMBL5277290 0.84
SCHEMBL5279540 0.76 TSHR (0.33) TSHRTHRB
SCHEMBL5279175 0.73 TSHR (0.31) TSHRTHRB
SCHEMBL2380894 0.73 FAAH (0.32) CES1TSHRTHRBFAAHCES2
SCHEMBL5282819 0.68 TSHR (0.42) TSHRTHRBMEN1KMT2AHSD17B10
SCHEMBL5278284 0.67
SCHEMBL5273940 0.66

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-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed