SCHEMBL8327550

SCHEMBL8327550

CNC(NC1CC2CN(C)CC(C1)N2C)C(C#N)C#N

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 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
SCHEMBL8327591 0.84 HTR3A (0.32) CHRM1SLC6A2SLC6A4
SCHEMBL8802038 0.66 HTR3A (0.30)
SCHEMBL18069713 0.64
SCHEMBL23315663 0.64
SCHEMBL2736039 0.64
SCHEMBL17057298 0.59 LMNA (0.46) CHRM1SLC6A2
SCHEMBL278109 0.59 LMNA (0.46) CHRM1SLC6A2
SCHEMBL16603050 0.59 LMNA (0.46) CHRM1SLC6A2
SCHEMBL12398381 0.59 LMNA (0.46) CHRM1SLC6A2
SCHEMBL22113083 0.58 CHRM1 (0.49) CHRM1SLC6A2SLC6A4

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
EP-0760368-B1 PYRIMIDINE DERIVATIVES NISSHIN FLOUR MILLING CO (JP) 1999-07-28 EP disclosed
EP-0760362-A1 NOVEL DIAMINOMETHYLIDENE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed
EP-0760368-A1 NOVEL PYRIMIDINE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed