SCHEMBL5279341

SCHEMBL5279341

CCCc1c(C(F)(F)F)nnn1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 10/20 0.35
GABRA2 P47869 4/20 0.31
GABRB2 P47870 4/20 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
SCHEMBL5283966 0.90 PDE2A (0.34) GABRA2GABRB2
SCHEMBL5278840 0.88 GABRB3 (0.31) GABRB3
SCHEMBL5284356 0.87 GABRB3 (0.33) GABRB3GABRA2GABRB2
SCHEMBL5276626 0.86
SCHEMBL5277909 0.84
SCHEMBL5277469 0.82
SCHEMBL5277922 0.81
SCHEMBL5280730 0.81
SCHEMBL5275085 0.79 PDE2A (0.31)
SCHEMBL5274001 0.78 TOP2A (0.30)

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