SCHEMBL7290237

SCHEMBL7290237

CN(C)CCCN(C(=O)c1ccccc1)c1ccccc1SCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 7/20 0.69
UBE2N P61088 2/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RAD52 P43351 3/20 0.40
ADRA2C P18825 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTPRC P08575 1/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL7288977 0.93 NPY2R (0.58) NPY2RUBE2NNPC1KMT2AMEN1
SCHEMBL9736552 0.92 NPY2R (0.62) NPY2RUBE2NNPC1KMT2AMEN1
SCHEMBL9735019 0.92 NPY2R (0.62) NPY2RUBE2NNPC1KMT2AMEN1
SCHEMBL7290248 0.88 NPY2R (0.69) NPY2RKMT2AL3MBTL1PTPRC
Oxalic Acid SCHEMBL7291345 0.86 NPY2R (0.63) NPY2RKMT2AL3MBTL1PTPRCSIGMAR1
SCHEMBL7297873 0.84 NPY2R (0.67) NPY2RKMT2ASIGMAR1
SCHEMBL7290404 0.82 NPY2R (0.65) NPY2RNPC1KMT2AL3MBTL1
SCHEMBL7290591 0.82 NPY2R (0.61) NPY2RKMT2AMEN1RAD52L3MBTL1
SCHEMBL7288694 0.82 NPY2R (0.61) NPY2RKMT2AMEN1RAD52L3MBTL1
SCHEMBL7290434 0.81 NPY2R (0.96) NPY2RNPC1KMT2AMEN1L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5116851-A Administering antiischemic and antiarrhythmia agents E. R. SQUIBB & SONS, INC. (US) 1992-05-26 US claimed
US-5116851-A Administering antiischemic and antiarrhythmia agents E. R. SQUIBB & SONS, INC. (US) 1992-05-26 US disclosed
EP-0453658-A2 Use of substituted anilides and sulfonamides in the treatment of cardiovascular diseases E.R. SQUIBB & SONS, INC. (US) 1991-10-30 EP disclosed