SCHEMBL21986396

SCHEMBL21986396

CCN(CC)[C@@H]1CCN(C(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.36
PGR P06401 1/20 0.33
KCNH2 Q12809 1/20 0.30
TP53 P04637 1/20 0.30
NSD2 O96028 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
SCHEMBL24855104 1.00 HRH3 (0.36) HRH3PGRKCNH2TP53NSD2
SCHEMBL10176831 1.00 HRH3 (0.36) HRH3PGRKCNH2TP53NSD2
SCHEMBL24317711 0.89 HRH3 (0.36) HRH3
SCHEMBL10098676 0.88 HRH3 (0.40) HRH3TP53
SCHEMBL8438506 0.86 HRH3 (0.38) HRH3PGR
SCHEMBL13242282 0.85
SCHEMBL21371149 0.83
SCHEMBL20906895 0.82 HRH3 (0.38) HRH3PGRKCNH2
SCHEMBL24854806 0.82 HRH3 (0.38) HRH3PGRKCNH2
SCHEMBL10176833 0.82 HRH3 (0.38) HRH3PGRKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3172214-B1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE DERIVATIVES AS CDK INHIBITORS AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2020-05-13 EP disclosed