SCHEMBL932385

SCHEMBL932385

Cc1nc(C(Cc2[c]cc(NS(=O)(=O)O)cc2)Nc2ncc(-c3ccccc3)o2)cs1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 15/20 0.46
FLT1 P17948 4/20 0.38
FLT4 P35916 4/20 0.38
KDR P35968 4/20 0.38
VCP P55072 1/20 0.36

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
SCHEMBL468096 0.91 PTPRB (0.53) PTPRBFLT1FLT4KDRVCP
SCHEMBL500277 0.88 PTPRB (0.59) PTPRB
SCHEMBL500276 0.88 PTPRB (0.59) PTPRB
SCHEMBL468151 0.83 PTPRB (0.43) PTPRBFLT1FLT4KDRVCP
SCHEMBL12943898 0.80 PTPRB (0.53) PTPRB
SCHEMBL468205 0.80 PTPRB (0.42) PTPRB
SCHEMBL500134 0.79 PTPRB (0.67) PTPRB
SCHEMBL500135 0.79 PTPRB (0.67) PTPRB
SCHEMBL467271 0.79 PTPRB (0.47) PTPRB
SCHEMBL683498 0.77 PTPRB (0.51) 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-2011005330-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR PREVENTING METASTASIS OF CANCER CELLS AKEBIA THERAPEUTICS INC. (US) 2011-01-13 WO disclosed