SCHEMBL8107053

SCHEMBL8107053

CC(C)(C)OC(=O)N1CCC(n2cc(-c3ccc(O)cc3)c3c(N)ncnc32)CC1

nearest known ligand 0.90

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.90
EGFR P00533 6/20 0.76
ABL1 P00519 5/20 0.73
ABL2 P42684 5/20 0.73
RIPK2 O43353 1/20 0.63
RET P07949 1/20 0.61
KIF5B P33176 1/20 0.61
KDR P35968 1/20 0.61

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
SCHEMBL8107904 0.95 SRC (1.00) SRCEGFRABL1ABL2RET
SCHEMBL28667953 0.94 SRC (0.79) SRCEGFRABL1ABL2RIPK2
SCHEMBL13020336 0.92 SRC (0.76) SRCEGFRABL1ABL2RIPK2
SCHEMBL8098919 0.92 SRC (0.90) SRCEGFRABL1ABL2RIPK2
SCHEMBL8098960 0.91 SRC (0.90) SRCEGFRABL1ABL2RIPK2
SCHEMBL8098935 0.89 SRC (0.90) SRCEGFRABL1ABL2RET
SCHEMBL30054291 0.89 SRC (0.78) SRCEGFRABL1ABL2RET
SCHEMBL6462070 0.89 SRC (0.78) SRCEGFRABL1ABL2RET
SCHEMBL20351767 0.88 SRC (0.88) SRCEGFRABL1ABL2
SCHEMBL7023465 0.87 SRC (0.72) SRCEGFRABL1ABL2RIPK2

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
EP-0993442-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-04-19 EP disclosed
US-6051577-A TYROSINE INHIBITORS; BONE DISORDERS NOVARTIS AG (CH) 2000-04-18 US disclosed
WO-1999001428-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-01-14 WO disclosed