SCHEMBL7474655

SCHEMBL7474655

CN(C(=O)O)[C@H]1CC[C@H](NC(N)=S)CC1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.34
SMYD3 Q9H7B4 5/20 0.33
POLB P06746 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
GAA P10253 1/20 0.31
ABCC1 P33527 1/20 0.31
ALDH1A1 P00352 2/20 0.31
RECQL P46063 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 1/20 0.31
MAPK1 P28482 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
PTPN11 Q06124 1/20 0.31
FAAH O00519 1/20 0.31
PHGDH O43175 1/20 0.31
MGLL Q99685 1/20 0.31
PKM P14618 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL5121347 1.00 NPY5R (0.34) NPY5RSMYD3POLBSMN1; SMN2GAA
SCHEMBL5393969 0.79 GAA (0.40) SMYD3GAA
SCHEMBL5393972 0.79 GAA (0.40) SMYD3GAA
SCHEMBL217412 0.77
SCHEMBL7498983 0.76 FASN (0.42) NPY5RSMYD3POLB
SCHEMBL4532414 0.76 ATM (0.34) NPY5RABCC1ALDH1A1
SCHEMBL5122584 0.75 PIN1 (0.33) POLBALDH1A1
SCHEMBL5395358 0.75 PIN1 (0.33) POLBALDH1A1
SCHEMBL5131730 0.75 SMN1; SMN2 (0.39) POLBSMN1; SMN2GAAALDH1A1NPC1
Hydrochloric Acid SCHEMBL4471911 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194421-A4 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2002-09-11 EP disclosed
EP-1194421-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2002-04-10 EP disclosed
US-6214853-B1 DIETETICS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-04-10 US disclosed
WO-2001002379-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2001-01-11 WO disclosed