SCHEMBL27770305

SCHEMBL27770305

C[C@@H]1CN(CC(=O)O)CCN1C(c1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 14/20 0.56
OPRD1 P41143 1/20 0.42

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
SCHEMBL11895453 1.00 SLC6A9 (0.56) SLC6A9OPRD1
SCHEMBL4143907 0.94 SLC6A9 (0.58) SLC6A9OPRD1
SCHEMBL4144761 0.94 SLC6A9 (0.58) SLC6A9OPRD1
SCHEMBL4143908 0.94 SLC6A9 (0.58) SLC6A9OPRD1
Hydrochloric Acid SCHEMBL4150506 0.92 SLC6A9 (0.56) SLC6A9OPRD1
Hydrochloric Acid SCHEMBL4151966 0.92 SLC6A9 (0.56) SLC6A9OPRD1
Hydrochloric Acid SCHEMBL4150503 0.92 SLC6A9 (0.56) SLC6A9OPRD1
SCHEMBL4152195 0.85 DPP8 (0.49) SLC6A9
SCHEMBL4152199 0.85 DPP8 (0.49) SLC6A9
Hydrochloric Acid SCHEMBL4135990 0.84 DPP8 (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101479243-A Glycine transporter-1 inhibitors AMGEN INC (US) 2009-07-08 CN claimed
CN-101479243-B Glycine transporter-1 inhibitors AMGEN INC 2013-01-02 CN disclosed
CN-101479243-A Glycine transporter-1 inhibitors AMGEN INC (US) 2009-07-08 CN disclosed