SCHEMBL19649501

SCHEMBL19649501

N[C@@H](Cc1ccc(NS(=O)(=O)O)cc1)c1cscn1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTPRB P23467 18/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.40
▸ RAD52 P43351 1/20 0.38

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
SCHEMBL876086 0.83 PTPRB (0.45) PTPRB
SCHEMBL21514754 0.80 RAD52 (0.36) TAAR1RAD52
SCHEMBL4012767 0.80 PTPRB (0.43) PTPRB
SCHEMBL5112414 0.79 TAAR1 (0.44) TAAR1RAD52
SCHEMBL19575794 0.74 PTPRB (0.56) PTPRB
SCHEMBL19649500 0.74 PTPRB (0.51) PTPRB
SCHEMBL19649516 0.74 PTPRB (0.68) PTPRBTAAR1
SCHEMBL11757925 0.74 PTPRB (0.56) PTPRB
SCHEMBL14635271 0.71 PTPRB (0.74) PTPRB
SCHEMBL14635272 0.71 PTPRB (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2803663-B1 Human protein tyrosine phosphatase inhibitors and their pharmaceutical use AERPIO THERAPEUTICS INC (US) 2017-11-29 — — EP disclosed
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