SCHEMBL8154274

SCHEMBL8154274

Cn1cc(C2=C(c3cn(CCC(N)=O)c4ccccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.71
CAMK2D Q13557 1/20 0.71
CCNE2 O96020 1/20 0.67
CDK4 P11802 1/20 0.67
CCND1 P24385 1/20 0.67
CCNE1 P24864 1/20 0.67
CDK2 P24941 1/20 0.67
PRKCA P17252 2/20 0.67
MEN1 O00255 1/20 0.67
CASK O14936 1/20 0.67
CCNT1 O60563 1/20 0.67
RPS6KA5 O75582 1/20 0.67
CCNK O75909 1/20 0.67
STK10 O94804 1/20 0.67
PRKD3 O94806 1/20 0.67
TP53 P04637 1/20 0.67
PRKCG P05129 1/20 0.67
PRKCB P05771 1/20 0.67
CYP3A4 P08684 1/20 0.67
MAPT P10636 1/20 0.67

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
SCHEMBL30319767 0.94 PIM1 (0.77) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL5686004 0.94 PIM1 (0.77) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8167286 0.93 PIM1 (0.76) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8161998 0.89 PIM1 (0.69) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL30834702 0.89 PIM1 (0.69) PIM1CAMK2DCCNE2CDK4CCND1
Hydrochloric Acid SCHEMBL8163206 0.88 PIM1 (0.86) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8161877 0.86 PRKACA (0.76) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL8161322 0.85 CCNE2 (0.74) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL30319793 0.85 PIM1 (0.73) PIM1CAMK2DCCNE2CDK4CCND1
SCHEMBL5688241 0.85 PIM1 (0.73) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36736-E Substituted pyrroles HOFFMAN-LA ROCHE INC. (US) 2000-06-13 US disclosed
EP-0328026-B1 SUBSTITUTED PYRROLES F. HOFFMANN-LA ROCHE AG (CH) 1993-04-28 EP disclosed
US-5057614-A Antiinflammatory, immunology, bronchodilator agents, cardiovascular disorders HOFFMANN-LA ROCHE INC. (US) 1991-10-15 US disclosed
EP-0328026-A1 Substituted pyrroles F. HOFFMANN-LA ROCHE AG (CH) 1989-08-16 EP disclosed