SCHEMBL28619155

SCHEMBL28619155

Fc1ccc(-n2cc(COc3ncc(Cl)cn3)nn2)cc1F

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.84
GRIN1 Q05586 20/20 0.84
GRIN2B Q13224 20/20 0.84

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
SCHEMBL19219654 0.91 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19211523 0.89 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219222 0.89 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219657 0.89 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219198 0.88 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219658 0.88 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19221898 0.87 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219295 0.87 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219653 0.87 RXRA (1.00) RXRAGRIN1GRIN2B
SCHEMBL19219656 0.87 RXRA (1.00) RXRAGRIN1GRIN2B

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-109071488-B Substituted 1,2, 3-triazoles as NR 2B-selective NMDA modulators 詹森药业有限公司 2021-08-13 CN claimed