SCHEMBL11240170

SCHEMBL11240170

CCc1[nH]c(=O)c(NC(=O)C(C)OC(C)=O)cc1-c1ccnc(C)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GPR142 Q7Z601 2/20 0.36
▸ PORCN Q9H237 1/20 0.35
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ PSEN1 P49768 9/20 0.35
▸ PSEN2 P49810 9/20 0.35
▸ APH1B Q8WW43 9/20 0.35
▸ NCSTN Q92542 9/20 0.35
▸ APH1A Q96BI3 9/20 0.35
▸ PSENEN Q9NZ42 9/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ CCNC P24863 1/20 0.34
▸ CDK8 P49336 1/20 0.34
▸ MAPK1 P28482 2/20 0.33
▸ TLR8 Q9NR97 1/20 0.33
▸ TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL11229983 0.80 PDE3B (0.38) GPR142PDE3BPDE3APSEN1PSEN2
SCHEMBL11229981 0.80 PDE3B (0.38) GPR142PDE3BPDE3APSEN1PSEN2
SCHEMBL11224972 0.76 PDE3B (0.40) PDE3BPDE3AABL1CCNCCDK8
SCHEMBL11224968 0.76 PDE3B (0.40) PDE3BPDE3AABL1CCNCCDK8
SCHEMBL11243508 0.72 PDE3B (0.43) PDE3BPDE3AABL1CCNCCDK8
SCHEMBL11244158 0.71 CCNC (0.49) PDE3BPDE3AABL1CCNCCDK8
SCHEMBL11234122 0.71 PDE3B (0.56) GPR142PDE3BPDE3ACCNCCDK8
SCHEMBL11238599 0.71 PDE3B (0.49) PDE3BPDE3ACCNCCDK8MAPK1
SCHEMBL11236017 0.71 MAPK1 (0.49) PDE3BPDE3AABL1CCNCCDK8
SCHEMBL11236041 0.70 PDE3B (0.41) PDE3BPDE3AABL1CCNCCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365065-A 1-(Pyridinyl)-2-(dimethylamino)ethenyl lower-alkyl ketones STERLING DRUG INC. (US) 1982-12-21 — — US disclosed
US-4313951-A 3-Substituted-6-(lower-alkyl)-5-(pyridinyl)-2(1H)-pyridinones, their cardiotonic use and intermediates therefor STERLING DRUG INC. (US) 1982-02-02 — — US disclosed
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