SCHEMBL8723375

SCHEMBL8723375

CN(C)C(=N)c1cc[nH]n1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL29023012 0.76
SCHEMBL2078311 0.75 SMN1; SMN2 (0.39)
SCHEMBL30195047 0.75
SCHEMBL22616190 0.75
SCHEMBL8307711 0.72
SCHEMBL27974128 0.71
SCHEMBL525584 0.71
SCHEMBL17654887 0.71
Trimethylammonium SCHEMBL27464061 0.71 HCAR2 (0.39) KDM4E
SCHEMBL10389675 0.71

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-0879227-A1 TYROSIN-DERIVATE AS ALPHA-V-INTEGRIN INHIBITORS MERCK PATENT GmbH (DE) 1998-11-25 EP disclosed
WO-1997023451-A1 TYROSIN-DERIVATE AS ALPHA-V-INTEGRIN INHIBITORS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1997-07-03 WO disclosed