SCHEMBL17030573

SCHEMBL17030573

CCS(=O)(=O)NCC(O)CI

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.30

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
SCHEMBL14845708 0.82 GRIA4 (0.35) GRIA4
SCHEMBL17030639 0.80 PER2 (0.44) GRIA4
SCHEMBL28305215 0.78 CA1 (0.32) GRIA4
SCHEMBL12745326 0.75
SCHEMBL10510598 0.75 TSHR (0.36) GRIA4
SCHEMBL598563 0.73 GRIA4 (0.32) GRIA4
SCHEMBL11715156 0.70 ALDH1A1 (0.33)
SCHEMBL777392 0.69 CA12 (0.39) GRIA4
SCHEMBL17149388 0.67 GRIA4 (0.37) GRIA4
SCHEMBL18215409 0.66

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2674428-B1 Modulators of ATP-binding cassette transporters VERTEX PHARMA (US) 2016-04-06 EP disclosed
EP-2007756-B1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2015-08-26 EP disclosed