SCHEMBL13734849

SCHEMBL13734849

CN1CCC(c2ccnn2-c2cc(C3CC3)[nH]n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.47
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK14 Q16539 1/20 0.35
IGF1R P08069 3/20 0.35

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
SCHEMBL13735480 0.77 GAA (0.36) DRD4GAASMN1; SMN2MAPK14
SCHEMBL13737236 0.71 KDM5A (0.44) DRD4IGF1R
SCHEMBL13734527 0.69 MEN1 (0.50) GAASMN1; SMN2IGF1R
SCHEMBL17001804 0.69 GAA (0.46) DRD4GAASMN1; SMN2
SCHEMBL13735207 0.69 GAA (0.44) GAASMN1; SMN2
SCHEMBL13735126 0.69 DRD4 (0.43) DRD4GAASMN1; SMN2MAPK14
SCHEMBL17001818 0.68 DRD4 (0.55) DRD4GAASMN1; SMN2MAPK14IGF1R
SCHEMBL13734629 0.68 ROCK2 (0.45)
SCHEMBL13734830 0.68 NT5E (0.45)
SCHEMBL15431898 0.68 HSD11B1 (0.47) DRD4GAASMN1; SMN2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP claimed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO claimed
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO disclosed