SCHEMBL3244486

SCHEMBL3244486

O=C(O)c1c[nH]c2c(=O)[nH]c3ccc(-c4ccnc(Nc5ccccc5)n4)cc3c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 4/20 0.51
CAMKK2 Q96RR4 3/20 0.51
CAMKK1 Q8N5S9 1/20 0.51
MAPK8 P45983 3/20 0.46
PIK3CG P48736 2/20 0.46
GSK3B P49841 2/20 0.46
JAK2 O60674 1/20 0.46
JAK3 P52333 1/20 0.46
SYK P43405 1/20 0.46
CDC7 O00311 2/20 0.46
PIK3C3 Q8NEB9 1/20 0.45
SPHK1 Q9NYA1 1/20 0.44
ABL1 P00519 3/20 0.44
BCR P11274 2/20 0.44
SRC P12931 1/20 0.44
PRKCA P17252 2/20 0.43
EGFR P00533 1/20 0.43
PRKCD Q05655 1/20 0.43
PIK3CA P42336 1/20 0.43
MAPK10 P53779 1/20 0.42

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
SCHEMBL3244692 0.88 SPHK1 (0.43) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG
SCHEMBL3245637 0.88 DDX3X (0.41) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG
SCHEMBL3245619 0.88 AURKA (0.47) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG
SCHEMBL3245517 0.85 PDPK1 (0.46) CAMKK2CAMKK1MAPK8PIK3CGGSK3B
SCHEMBL4161175 0.85 CAMK2D (0.45) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG
SCHEMBL3249380 0.82 CAMKK2 (0.46) CAMKK2MAPK8GSK3BJAK2JAK3
SCHEMBL3254744 0.82 JAK2 (0.44) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG
SCHEMBL3244502 0.81 CSNK2A1 (0.49) GSK3B
SCHEMBL3251264 0.81 PDPK1 (0.43)
SCHEMBL4713573 0.81 PIK3C3 (0.49) CAMK2DCAMKK2CAMKK1MAPK8PIK3CG

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
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP disclosed