SCHEMBL8079989

SCHEMBL8079989

Cn1cc(C2=C(c3cn(Cc4cccc(CN)c4)c4ccc(CC(=O)O)cc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 4/20 0.61
PRKCA P17252 4/20 0.61
PRKCD Q05655 2/20 0.58
PRKCH P24723 1/20 0.58
PRKCE Q02156 1/20 0.58
PRKCQ Q04759 1/20 0.58
PIM1 P11309 1/20 0.54
CAMK2D Q13557 1/20 0.54
CCNE2 O96020 1/20 0.52
CDK4 P11802 1/20 0.52
CCND1 P24385 1/20 0.52
CCNE1 P24864 1/20 0.52
CDK2 P24941 1/20 0.52

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
SCHEMBL8065185 0.89 PRKCA (0.68) PRKCBPRKCAPRKCDPRKCHPRKCE
Hydrochloric Acid SCHEMBL8064918 0.88 PRKCA (0.67) PRKCBPRKCAPRKCDPRKCHPRKCE
Hydrochloric Acid SCHEMBL8064897 0.85 PRKCB (0.58) PRKCBPRKCAPRKCDPRKCHPRKCE
SCHEMBL8317085 0.84 PRKCA (0.59) PRKCBPRKCAPRKCDPRKCHPRKCE
SCHEMBL8080083 0.84 PRKCA (0.59) PRKCBPRKCAPRKCDPRKCHPRKCE
SCHEMBL8075459 0.84 PIM1 (0.70) PRKCBPRKCAPRKCDPRKCHPRKCE
Hydrochloric Acid SCHEMBL8078088 0.84 PRKCA (0.58) PRKCBPRKCAPRKCDPRKCHPRKCE
SCHEMBL8072942 0.82 CCNE2 (0.62) PRKCAPIM1CAMK2DCCNE2CDK4
SCHEMBL8075384 0.81 PRKCA (0.61) PRKCBPRKCAPRKCDPRKCHPRKCE
SCHEMBL8065080 0.81 PRKCA (0.54) PRKCBPRKCAPRKCDPRKCHPRKCE

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