SCHEMBL5083278

SCHEMBL5083278

Nc1nccn2c(C3CCC3)nc(-c3cc4nc(-c5[c]cccc5)ccc4cc3Cl)c12

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.58
CYP3A4 P08684 1/20 0.58
TNK2 Q07912 16/20 0.56
FGFR1 P11362 2/20 0.49

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
SCHEMBL401087 0.87 IGF1R (0.75) IGF1RCYP3A4TNK2FGFR1
SCHEMBL401143 0.86 IGF1R (0.61) IGF1RCYP3A4TNK2FGFR1
SCHEMBL399407 0.83 IGF1R (0.59) IGF1RCYP3A4TNK2FGFR1
Carbamic Acid SCHEMBL4072218 0.81 IGF1R (0.66) IGF1RCYP3A4TNK2FGFR1
Carbamic Acid SCHEMBL4074258 0.80 TNK2 (0.61) IGF1RCYP3A4TNK2
SCHEMBL397033 0.80 TNK2 (0.61) IGF1RCYP3A4TNK2FGFR1
SCHEMBL400980 0.80 TNK2 (0.72) TNK2
SCHEMBL402699 0.79 IGF1R (0.62) IGF1RCYP3A4TNK2FGFR1
SCHEMBL400761 0.77 IGF1R (0.78) IGF1RCYP3A4TNK2FGFR1
SCHEMBL402214 0.77 IGF1R (0.61) IGF1RCYP3A4TNK2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008076143-A1 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI PHARMACEUTICALS, INC. (US) 2008-06-26 WO claimed
EP-1979002-A2 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI Pharmaceuticals, Inc. (US) 2008-10-15 EP disclosed
WO-2007075554-A2 COMBINATION OF IGFR INHIBITOR AND ANTI-CANCER AGENT OSI PHARMACEUTICALS, INC. (US) 2007-07-05 WO disclosed