SCHEMBL5283966

SCHEMBL5283966

CCCCc1c(C(F)(F)F)nnn1C(C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.34
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33

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
SCHEMBL5279341 0.90 GABRB3 (0.35) GABRA2GABRB2
SCHEMBL5275085 0.89 PDE2A (0.31) PDE2A
SCHEMBL5280338 0.87 PDE2A (0.30) PDE2A
SCHEMBL5278445 0.85 MAOB (0.31) PDE2A
SCHEMBL5284356 0.84 GABRB3 (0.33) GABRA2GABRB2
SCHEMBL5274990 0.83
SCHEMBL5277469 0.79
SCHEMBL5277937 0.79 MAOB (0.31)
SCHEMBL5278793 0.79 MAOB (0.38)
SCHEMBL5278840 0.79 GABRB3 (0.31)

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