SCHEMBL5828027

SCHEMBL5828027

O=C1C(Br)=C(c2c[nH]c3ncccc23)C(=O)N1COCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.47
CDC7 O00311 7/20 0.45
DBF4 Q9UBU7 5/20 0.45
MET P08581 3/20 0.42
SIRT2 Q8IXJ6 1/20 0.41
ROCK1 Q13464 2/20 0.41
CDK2 P24941 4/20 0.41
KDR P35968 3/20 0.41
FLT3 P36888 3/20 0.41
PLK4 O00444 2/20 0.41
CHEK1 O14757 2/20 0.41
JAK2 O60674 2/20 0.41
ROCK2 O75116 2/20 0.41
EGFR P00533 2/20 0.41
CSF1R P07333 2/20 0.41
RET P07949 2/20 0.41
FGFR1 P11362 2/20 0.41
PRKACA P17612 2/20 0.41
TYK2 P29597 2/20 0.41
AKT1 P31749 2/20 0.41

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
SCHEMBL3050825 0.87 SIRT2 (0.56) PIM1CDC7DBF4METSIRT2
SCHEMBL5828525 0.85 SIRT2 (0.59) PIM1SIRT2CDK2PRKACAGSK3B
SCHEMBL5828128 0.79 CCNE1 (0.44) PIM1CDC7DBF4METSIRT2
SCHEMBL5828893 0.79 CDK2 (0.52) PIM1CDC7DBF4METSIRT2
SCHEMBL3971688 0.79 TRPM8 (0.46) SIRT2
SCHEMBL9374063 0.76 SIRT2 (0.70) PIM1SIRT2CDK2PRKACAGSK3B
SCHEMBL5828735 0.75 PIM1 (0.54) PIM1CDC7SIRT2CDK2KDR
SCHEMBL5828559 0.74 ALDH1A1 (0.49) GSK3BMAPK1
SCHEMBL5827925 0.69 SIRT2 (0.48) PIM1SIRT2CDK2PRKACAGSK3B
SCHEMBL5828116 0.69 HTR6 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7001906-B2 Pyrido-pyrido-pyrrolo pyrrolo-indole and pyrido-pyrrolo pyrrolo carbazole derivatives, method for the production thereof and pharmaceutical compositions containing said derivatives LES LABORATOIRES SERVIER (FR) 2006-02-21 US disclosed