SCHEMBL28120426

SCHEMBL28120426

CC(C)(C)OC(=O)NCC1CCN(c2ccc(F)cc2OC(N)=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 1/20 0.47
▸ SKP1 P63208 1/20 0.47
▸ SKP2 Q13309 1/20 0.47
▸ ACACB O00763 7/20 0.46
▸ ACACA Q13085 6/20 0.46
▸ DRD2 P14416 3/20 0.46
▸ SUV39H2 Q9H5I1 2/20 0.42
▸ JAK1 P23458 2/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.41
▸ SIRT3 Q9NTG7 1/20 0.41
▸ F10 P00742 1/20 0.41

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
SCHEMBL8221705 0.85 CKS1B (0.48) CKS1BSKP1SKP2ACACBACACA
SCHEMBL8214675 0.84 CKS1B (0.49) CKS1BSKP1SKP2ACACBACACA
SCHEMBL28926895 0.84 CKS1B (0.49) CKS1BSKP1SKP2ACACBACACA
SCHEMBL16896516 0.83 CKS1B (0.51) CKS1BSKP1SKP2ACACBACACA
SCHEMBL28642833 0.83 CKS1B (0.46) CKS1BSKP1SKP2ACACBACACA
SCHEMBL28120169 0.83 CKS1B (0.46) CKS1BSKP1SKP2ACACBACACA
SCHEMBL16896437 0.82 CKS1B (0.48) CKS1BSKP1SKP2ACACBACACA
SCHEMBL8222029 0.80 CKS1B (0.53) CKS1BSKP1SKP2ACACBACACA
SCHEMBL13419702 0.80 ACACB (0.49) CKS1BSKP1SKP2ACACBACACA
SCHEMBL28648284 0.80 CKS1B (0.45) CKS1BSKP1SKP2ACACBACACA

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
CN-106456619-A Bicyclic heterocyclic derivatives as IRAK4 inhibitors 奥列基因发现技术有限公司 2017-02-22 — — CN disclosed
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