SCHEMBL17424345

SCHEMBL17424345

Cc1ccc(C2CN(C(=O)OC(C)(C)C)CCN2C(=O)C2CCS(=O)(=O)CC2)s1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.58

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
SCHEMBL16640418 0.90 SLC6A9 (0.61) SLC6A9
SCHEMBL16640413 0.90 SLC6A9 (0.48) SLC6A9
SCHEMBL16640411 0.90 SLC6A9 (0.61) SLC6A9
SCHEMBL16640419 0.89 SLC6A9 (0.61) SLC6A9
SCHEMBL16640378 0.85 SLC6A9 (0.62) SLC6A9
SCHEMBL16640414 0.83 SLC6A9 (0.57) SLC6A9
SCHEMBL16640417 0.81 SLC6A9 (0.59) SLC6A9
SCHEMBL16640407 0.80 SLC6A9 (0.60) SLC6A9
SCHEMBL16640410 0.79 SLC6A9 (0.60) SLC6A9
SCHEMBL16640435 0.78 SLC6A9 (0.61) 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
EP-3057963-B1 PIPERAZINE DERIVATIVES AND THE USE THEREOF AS MEDICAMENT BOEHRINGER INGELHEIM INT (DE) 2019-06-19 EP disclosed
US-9233953-B2 Derivatives of 4-(piperazinylcarbonyl)thiane-1, 1-dione which inhibit GlyT1 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-01-12 US disclosed
US-9233953-B2 Derivatives of 4-(piperazinylcarbonyl)thiane-1, 1-dione which inhibit GlyT1 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-01-12 US disclosed