SCHEMBL13736723

SCHEMBL13736723

O=Cc1cc(N2CCC(CNC(=O)O)CC2)ncn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 12/20 0.41
SKP1 P63208 12/20 0.41
SKP2 Q13309 12/20 0.41
SIRT2 Q8IXJ6 2/20 0.39
SIRT1 Q96EB6 2/20 0.39
SIRT3 Q9NTG7 2/20 0.39
LOXL2 Q9Y4K0 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.37
CHEK1 O14757 1/20 0.36
CHEK2 O96017 1/20 0.36

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
SCHEMBL13556491 0.83 CKS1B (0.55) CKS1BSKP1SKP2SIRT2SIRT1
SCHEMBL19489712 0.81 MAP4K4 (0.39) SIRT2SIRT1SIRT3LOXL2CHEK1
SCHEMBL13736221 0.80 PIM1 (0.44) SIRT2SIRT1SIRT3HPGD
SCHEMBL13736218 0.80 PIM1 (0.44) SIRT2SIRT1SIRT3HPGD
SCHEMBL1729041 0.79 NPC1 (0.55) CKS1BSKP1SKP2TSHR
SCHEMBL1728003 0.77 CD38 (0.43) CKS1BSKP1SKP2TSHRHSD17B10
SCHEMBL27920414 0.76 GPR119 (0.48) CKS1BSKP1SKP2
SCHEMBL13387983 0.76 HRH4 (0.35) CKS1BSKP1SKP2SIRT2SIRT1
SCHEMBL29931619 0.76 DKK1 (0.49) CKS1BSKP1SKP2KDM4EALDH1A1
SCHEMBL1774210 0.76 LOXL2 (0.41) CKS1BSKP1SKP2SIRT2SIRT1

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-2699569-B1 AMINOPYRIMIDINE KINASE INHIBITORS JASCO PHARMACEUTICALS LLC (US) 2017-08-30 EP disclosed
EP-2699569-A2 AMINOPYRIMIDINE KINASE INHIBITORS Jasco Pharmaceuticals LLC (US) 2014-02-26 EP disclosed
WO-2012145617-A9 AMINOPYRIMIDINE KINASE INHIBITORS Jasco Pharmaceuticals, LLC (US) 2014-02-20 WO disclosed
WO-2012145617-A2 AMINOPYRIMIDINE KINASE INHIBITORS Jasco Pharmaceuticals, LLC (US) 2012-10-26 WO disclosed