SCHEMBL8079966

SCHEMBL8079966

Cn1cc(C2=C(c3cn(Cc4ccc(CN)s4)c4ccccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.66
CAMK2D Q13557 1/20 0.66
CCNE2 O96020 2/20 0.62
CDK4 P11802 2/20 0.62
CCND1 P24385 2/20 0.62
CCNE1 P24864 2/20 0.62
CDK2 P24941 2/20 0.62
PRKCA P17252 2/20 0.58
PRKACA P17612 1/20 0.58
PRKACG P22612 1/20 0.58
PRKACB P22694 1/20 0.58
MEN1 O00255 1/20 0.55
CASK O14936 1/20 0.55
CCNT1 O60563 1/20 0.55
RPS6KA5 O75582 1/20 0.55
CCNK O75909 1/20 0.55
STK10 O94804 1/20 0.55
PRKD3 O94806 1/20 0.55
TP53 P04637 1/20 0.55
PRKCG P05129 1/20 0.55

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
SCHEMBL8075578 0.89 CCNE2 (0.62) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8578928 0.85 CCNE2 (0.59) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8075731 0.84 PIM1 (0.70) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8075459 0.84 PIM1 (0.70) PIM1CAMK2DCCNE2CDK4CCND1
Hydrochloric Acid SCHEMBL8163206 0.82 PIM1 (0.86) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8065185 0.81 PRKCA (0.68) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8167903 0.81 CCNE2 (0.72) PIM1CAMK2DCCNE2CDK4CCND1
Hydrochloric Acid SCHEMBL8064918 0.80 PRKCA (0.67) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8079796 0.80 PIM1 (0.65) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL29438694 0.80 CAMK2D (1.00) PIM1CAMK2DCCNE2CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6153641-A Pharmaceutically active compounds ASTRA AKTIEBOLAG (SE) 2000-11-28 US claimed
EP-0925296-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS Astra Aktiebolag (SE) 1999-06-30 EP claimed
WO-1998011102-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRA AKTIEBOLAG (SE) 1998-03-19 WO claimed
US-6153641-A Pharmaceutically active compounds ASTRA AKTIEBOLAG (SE) 2000-11-28 US disclosed
EP-0925296-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS Astra Aktiebolag (SE) 1999-06-30 EP disclosed
WO-1998011102-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRA AKTIEBOLAG (SE) 1998-03-19 WO disclosed