Ethylene

Ethylene

SCHEMBL6271500

C=C.CC(C)C(=O)Cn1c(N)nc2[nH]cnc2c1=O.CCOC(C)OCC

nearest known ligand 0.32

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.31
▸ PDE4B Q07343 2/20 0.31
▸ PDE4C Q08493 2/20 0.31
▸ PDE4D Q08499 2/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL6268075 0.89 ADORA2A (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL6271387 0.79 CDK1 (0.37) PDE4APDE4BPDE4CPDE4D
SCHEMBL6266771 0.76 CDK1 (0.36) PDE4APDE4BPDE4CPDE4D
SCHEMBL6265529 0.75 PDE4A (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL2113436 0.74 ADORA2A (0.33) PDE4APDE4BPDE4CPDE4D
SCHEMBL874734 0.73 ADORA2A (0.45) PDE4APDE4BPDE4CPDE4D
SCHEMBL1767742 0.73 ADORA2A (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL5503490 0.72 ADORA2A (0.49) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL473734 0.72 ADORA2A (0.32) PDE4APDE4BPDE4CPDE4D
SCHEMBL8343186 0.72 HPRT1 (0.31) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1017394-B1 CYCLIN DEPENDENT KINASE INHIBITING PURINE DERIVATIVES CANCER REC TECH LTD (GB) 2005-12-07 — — EP disclosed
US-6303618-B1 ADMINISTERING PURINE COMPOUND WHICH INHIBITS CYCLIC DEPENDENT KINASE ACTIVITY FOR THERAPY OF TUMOR OR OTHER CELL PROLIFERATION DISORDER CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2001-10-16 — — US disclosed
EP-1017394-A1 CYCLIN DEPENDENT KINASE INHIBITING PURINE DERIVATIVES CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2000-07-12 — — EP disclosed
WO-1999002162-A9 CYCLIN DEPENDENT KINASE INHIBITING PURINE DERIVATIVES CANCER RES CAMPAIGN TECH (GB) 1999-07-29 — — WO disclosed
WO-1999002162-A1 CYCLIN DEPENDENT KINASE INHIBITING PURINE DERIVATIVES CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1999-01-21 — — WO disclosed
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