SCHEMBL2485210

SCHEMBL2485210

CC1=C[CH]CC=C1N1CCN(C2CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
HRH3 Q9Y5N1 3/20 0.33
GRIN2B Q13224 1/20 0.32
GAA P10253 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
SCHEMBL2480167 0.94 HRH3 (0.36) HRH3GAA
SCHEMBL467489 0.88 PIM1 (0.36) HRH3
SCHEMBL1385856 0.79 ADRA2C (0.33) KMT2AHRH3GAA
SCHEMBL2483016 0.78 GPR119 (0.30)
SCHEMBL2482791 0.76 CASP1 (0.34)
SCHEMBL2480845 0.75 KDM4E (0.39) HRH3GAA
SCHEMBL2477477 0.72 NPSR1 (0.43) KMT2AMEN1
SCHEMBL2482995 0.71 MEN1 (0.39) KMT2AMEN1GAA
SCHEMBL467680 0.71 KCNH2 (0.38)
SCHEMBL468653 0.68 L3MBTL3 (0.46) HRH3

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-2376493-A1 DIHYDROPYRIMIDOPYRIMIDINE DERIVATIVE MSD K.K. (JP) 2011-10-19 EP disclosed
WO-2010067886-A1 DIHYDROPYRIMIDOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-06-17 WO disclosed