SCHEMBL3704124

SCHEMBL3704124

O=S(=O)(Cc1ccccc1)NC(Cc1cc[c]cc1)c1csc(-c2cccs2)n1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 13/20 0.50
KDM4E B2RXH2 5/20 0.41
NPC1 O15118 1/20 0.37
SLC6A3 Q01959 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL3704125 1.00 PTPRB (0.50) PTPRBKDM4ENPC1SLC6A3MAPT
SCHEMBL3715735 0.90 PTPRB (0.49) PTPRBKDM4ENPC1SLC6A3
SCHEMBL27921824 0.90 PTPRB (0.49) PTPRBKDM4ENPC1SLC6A3
SCHEMBL19945964 0.90 PTPRB (0.49) PTPRBKDM4ENPC1SLC6A3
SCHEMBL16079944 0.88 PTPRB (0.56) PTPRBKDM4ENPC1
SCHEMBL3693428 0.87 PTPRB (0.47) PTPRBKDM4ENPC1SLC6A3MAPT
SCHEMBL500500 0.85 PTPRB (0.49) PTPRBKDM4EMAPT
SCHEMBL16081630 0.85 PTPRB (0.57) PTPRBKDM4E
SCHEMBL500755 0.85 PTPRB (0.69) PTPRB
SCHEMBL500756 0.85 PTPRB (0.69) 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-2451279-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR PREVENTING METASTASIS OF CANCER CELLS Akebia Therapeutics Inc. (US) 2012-05-16 EP disclosed
WO-2010081172-A1 METHODS FOR TREATING VASCULAR LEAK SYNDROME AKEBIA THERAPEUTICS INC. (US) 2010-07-15 WO disclosed