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SCHEMBL4238736

SCHEMBL4238736

Cc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)c(-c1ccsc1)c(OCC1CC1)c(=O)n2C

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 7/20 0.51
▸ PLK1 P53350 7/20 0.47
▸ BRD4 O60885 6/20 0.47
▸ PTK2 Q05397 4/20 0.46
▸ PLK3 Q9H4B4 2/20 0.43
▸ PLK2 Q9NYY3 1/20 0.43
▸ DCLK1 O15075 1/20 0.42
▸ MAPK7 Q13164 1/20 0.42
▸ LRRK2 Q5S007 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
SCHEMBL4238679 0.93 IGF1R (0.50) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4235459 0.93 IGF1R (0.60) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4223710 0.93 IGF1R (0.50) IGF1RPLK1BRD4PTK2DCLK1
SCHEMBL4234109 0.92 IGF1R (0.54) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4241330 0.87 IGF1R (0.53) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4238618 0.86 PTK2 (0.48) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4238616 0.86 PTK2 (0.48) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4380887 0.86 IGF1R (0.63) IGF1RPLK1BRD4PTK2PLK3
SCHEMBL4235611 0.86 IGF1R (0.64) IGF1RPLK1BRD4PTK2DCLK1
SCHEMBL4239695 0.85 PTK2 (0.57) IGF1RPLK1BRD4PTK2PLK3

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
EP-2100894-A1 Pyridopyrimidines used as Plk1 (polo-like kinase) inhibitors 4SC AG (DE) 2009-09-16 — — EP disclosed