SCHEMBL4778720

SCHEMBL4778720

Cn1cc(-c2ccc(C(NC(=O)c3cccc(C(F)(F)F)c3Cl)[C@@H]3CCCCN3)cc2)cn1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 18/20 0.71
P2RX7 Q99572 1/20 0.43

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
SCHEMBL4778717 1.00 SLC6A9 (0.71) SLC6A9P2RX7
SCHEMBL4794575 0.92 SLC6A9 (0.69) SLC6A9P2RX7
SCHEMBL4794579 0.92 SLC6A9 (0.69) SLC6A9P2RX7
Hydrochloric Acid SCHEMBL4794871 0.92 SLC6A9 (0.68) SLC6A9P2RX7
Hydrochloric Acid SCHEMBL4794867 0.92 SLC6A9 (0.68) SLC6A9P2RX7
SCHEMBL8211148 0.91 SLC6A9 (0.58) SLC6A9P2RX7
SCHEMBL4796179 0.90 SLC6A9 (0.65) SLC6A9P2RX7
SCHEMBL4796183 0.90 SLC6A9 (0.65) SLC6A9P2RX7
SCHEMBL8213192 0.88 SLC6A9 (0.77) SLC6A9P2RX7
SCHEMBL8220931 0.87 SLC6A9 (0.89) SLC6A9

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
WO-2008018639-A2 GLYCINE TRANSPORTER INHIBITOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-02-14 WO disclosed