SCHEMBL13795763

SCHEMBL13795763

CCN(CC)c1nc(NC[C@H]2CC[C@H](CNS(=O)(=O)c3ccc(F)cc3)CC2)nc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 15/20 0.60
▸ ADRA2A P08913 9/20 0.60
▸ MCHR1 Q99705 9/20 0.57
▸ SLC6A4 P31645 2/20 0.55
▸ AQP1 P29972 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ NPY1R P25929 1/20 0.50
▸ NPY2R P49146 1/20 0.50
▸ NPY4R P50391 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ GBA1 P04062 1/20 0.46

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
SCHEMBL14606677 1.00 NPY5R (0.60) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796905 0.93 NPY5R (0.65) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796534 0.92 NPY5R (0.61) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796589 0.92 NPY5R (0.61) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796594 0.91 NPY5R (0.60) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796907 0.91 NPY5R (0.60) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13794352 0.91 NPY5R (0.73) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL14606985 0.90 NPY5R (0.59) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL14606989 0.89 NPY5R (0.58) NPY5RADRA2AMCHR1SLC6A4AQP1
SCHEMBL13796877 0.89 NPY5R (0.58) NPY5RADRA2AMCHR1SLC6A4AQP1

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
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
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