SCHEMBL1287174

SCHEMBL1287174

CCc1csc(C(Cc2ccc(NS(=O)(=O)O)cc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1

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
SCHEMBL679187 1.00 PTPRB (1.00) PTPRB
SCHEMBL468130 1.00 PTPRB (1.00) PTPRB
SCHEMBL468129 1.00 PTPRB (1.00) PTPRB
Ammonia Solution, Strong SCHEMBL468195 0.99 PTPRB (0.98) PTPRB
Ammonia Solution, Strong SCHEMBL6117471 0.99 PTPRB (0.98) PTPRB
Ammonia Solution, Strong SCHEMBL468198 0.99 PTPRB (0.98) PTPRB
SCHEMBL680192 0.92 PTPRB (1.00) PTPRB
SCHEMBL468317 0.92 PTPRB (1.00) PTPRB
Ammonia Solution, Strong SCHEMBL16030961 0.91 PTPRB (0.98) PTPRB
SCHEMBL19575842 0.91 PTPRB (0.83) 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-2624916-A2 COMPOSITIONS AND METHODS FOR TREATING OCULAR EDEMA, NEOVASCULARIZATION AND RELATED DISEASES Aerpio Therapeutics Inc. (US) 2013-08-14 EP claimed
WO-2012047966-A2 COMPOSITIONS AND METHODS FOR TREATING OCULAR EDEMA, NEOVASCULARIZATION AND RELATED DISEASES AKEBIA THERAPEUTICS INC. (US) 2012-04-12 WO claimed