SCHEMBL27913063

SCHEMBL27913063

CCOC(OC)n1ccnn1.F[B-](F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 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
SCHEMBL5400575 0.84 CYP19A1 (0.37) CYP19A1
SCHEMBL2659458 0.77 CYP19A1 (0.33) CYP19A1
SCHEMBL1131365 0.69 CYP19A1 (0.38) CYP19A1
SCHEMBL3303135 0.65
SCHEMBL12369613 0.63 CYP19A1 (0.41) CYP19A1
SCHEMBL11584116 0.62 CYP19A1 (0.37) CYP19A1
SCHEMBL28798620 0.62 CYP19A1 (0.40) CYP19A1
SCHEMBL14214803 0.61
SCHEMBL11474421 0.61
SCHEMBL20397431 0.61

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
CN-102956917-A Triazole ionic liquid, and preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-03-06 CN disclosed