SCHEMBL468243

SCHEMBL468243

COC(=O)NC(Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1nc(C(C)(C)C)cs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 20/20 1.00

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
SCHEMBL679273 1.00 PTPRB (1.00) PTPRB
SCHEMBL679274 1.00 PTPRB (1.00) PTPRB
SCHEMBL16061768 0.93 PTPRB (0.86) PTPRB
SCHEMBL3937502 0.92 PTPRB (1.00) PTPRB
SCHEMBL468131 0.92 PTPRB (1.00) PTPRB
SCHEMBL679344 0.92 PTPRB (1.00) PTPRB
SCHEMBL468258 0.89 PTPRB (1.00) PTPRB
SCHEMBL678492 0.89 PTPRB (1.00) PTPRB
SCHEMBL468324 0.88 PTPRB (1.00) PTPRB
SCHEMBL679547 0.88 PTPRB (1.00) PTPRB

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-2385763-A1 METHODS FOR TREATING VASCULAR LEAK SYNDROME Akebia Therapeutics Inc. (US) 2011-11-16 EP claimed
US-20110253725-A1 MULTI-PORT BEVERAGE AND FOOD CONTAINERS KILLIAN WILLIAM 2011-10-20 US claimed