SCHEMBL4065196

SCHEMBL4065196

N[N+]12C=CN=CC1=C(C1CC(CN3CCC3)C1)N=C2c1ccc2ccc(-c3ccccc3)nc2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.37
EGFR P00533 1/20 0.37
INSR P06213 1/20 0.37
CYP3A4 P08684 1/20 0.37
KDR P35968 1/20 0.37
TNK2 Q07912 1/20 0.30

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
SCHEMBL4066036 0.90 EGFR (0.32) IGF1REGFRINSRCYP3A4KDR
SCHEMBL4072094 0.88
SCHEMBL4071108 0.88 TNK2 (0.34) TNK2
SCHEMBL402424 0.86 IGF1R (0.41) IGF1REGFRINSRCYP3A4KDR
SCHEMBL4074254 0.86 IGF1R (0.36) IGF1RCYP3A4TNK2
SCHEMBL4067736 0.85 IGF1R (0.30) IGF1R
SCHEMBL397604 0.83 IGF1R (0.49) IGF1REGFRINSRCYP3A4KDR
SCHEMBL402211 0.82 IGF1R (0.47) IGF1REGFRINSRCYP3A4KDR
SCHEMBL4074268 0.81
SCHEMBL398029 0.79 IGF1R (0.41) IGF1RINSR

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-1740591-B1 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS OSI PHARM INC (US) 2009-06-17 EP claimed