SCHEMBL13301979

SCHEMBL13301979

Cc1ccc(NC(=O)c2cccc(CF)c2)cc1Nc1nccn1-c1cc(NC2CC2)ncn1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 0.54
LYN P07948 18/20 0.54
SRC P12931 18/20 0.54
KDR P35968 18/20 0.54
HCK P08631 18/20 0.54
INSR P06213 16/20 0.54
BTK Q06187 2/20 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
SCHEMBL13301928 0.91 LCK (0.47) LCKLYNSRCKDRHCK
SCHEMBL3232951 0.89 LCK (0.56) LCKLYNSRCKDRHCK
SCHEMBL1827464 0.88 LCK (0.69) LCKLYNSRCKDRHCK
SCHEMBL13301821 0.88 LCK (0.45) LCKLYNSRCKDRHCK
SCHEMBL13301782 0.87 LCK (0.47) LCKLYNSRCKDRHCK
SCHEMBL13301785 0.87 SRC (0.48) LCKLYNSRCKDRHCK
SCHEMBL13301994 0.87 HCK (0.44) LCKLYNSRCKDRHCK
SCHEMBL13301987 0.86 LYN (0.50) LCKLYNSRCKDRHCK
SCHEMBL13301855 0.86 LCK (0.45) LCKLYNSRCKDRHCK
SCHEMBL13301690 0.86 SRC (0.45) LCKLYNSRCKDRHCK

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-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed