SCHEMBL8326753

SCHEMBL8326753

COC(=O)N(Cc1ccc(F)cc1)C[C@@H]1CC[C@H](CN)O1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.45
SLC6A4 P31645 11/20 0.45
SLC6A3 Q01959 10/20 0.45
HTR2A P28223 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LPAR1 Q92633 2/20 0.37
LPAR5 Q9H1C0 2/20 0.37
PKM P14618 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.36
OXTR P30559 1/20 0.36
AVPR1A P37288 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
SCHEMBL8326747 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8323731 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8323723 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8323725 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8331211 0.90 HTR2A (0.38) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8326129 0.90 HTR2A (0.38) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8331217 0.90 HTR2A (0.38) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8326122 0.90 HTR2A (0.38) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8326125 0.90 HTR2A (0.38) SLC6A2SLC6A4SLC6A3HTR2AMEN1
SCHEMBL8328914 0.90 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3MEN1KMT2A

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-0760368-B1 PYRIMIDINE DERIVATIVES NISSHIN FLOUR MILLING CO (JP) 1999-07-28 EP disclosed
EP-0760368-A1 NOVEL PYRIMIDINE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed