SCHEMBL7320063

SCHEMBL7320063

CCc1nn(C2CCCC2)c2nc(-c3ccncc3OC)nc(N)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.39
BTK Q06187 4/20 0.39
ABL1 P00519 8/20 0.39
SRC P12931 8/20 0.39
PIK3CD O00329 7/20 0.39
HCK P08631 7/20 0.39
KDR P35968 7/20 0.39
PIK3CA P42336 7/20 0.39
PIK3CB P42338 7/20 0.39
MTOR P42345 7/20 0.39
PIK3CG P48736 7/20 0.39
EPHB4 P54760 7/20 0.39
PRKDC P78527 7/20 0.39
PI4KB Q9UBF8 7/20 0.39
PDE4A P27815 4/20 0.36
PDE4B Q07343 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
PDE5A O76074 1/20 0.36
FLT3 P36888 1/20 0.34

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
SCHEMBL7312127 0.91 PDE5A (0.42) EGFRBTKABL1SRCPIK3CD
SCHEMBL7313010 0.90 EGFR (0.36) EGFRBTKABL1SRCPIK3CD
SCHEMBL7322196 0.79 SRC (0.40) EGFRBTKABL1SRCPIK3CD
SCHEMBL8987482 0.73 PDE5A (0.37) EGFRABL1SRCPIK3CDHCK
SCHEMBL7317680 0.73 SRC (0.38) EGFRABL1SRCPIK3CDHCK
SCHEMBL7316542 0.71 EGFR (0.37) EGFRBTKABL1SRCPIK3CD
SCHEMBL7312223 0.70 TLR9 (0.39) EGFRABL1SRCPIK3CDHCK
SCHEMBL7315692 0.70 SRC (0.40) ABL1SRCPRKCIALDH1A1HSD17B10
SCHEMBL9081191 0.70 PDE4A (0.36) EGFRABL1SRCPIK3CDHCK
SCHEMBL7315674 0.69 SRC (0.39) EGFRABL1SRCPIK3CDHCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541187-A HYPOTENSIVE AGENTS STERLING WINTHROP INC. (US) 1996-07-30 US disclosed
US-5294612-A Hypotensive agents and cardiovascular disorders STERLING WINTHROP INC. (US) 1994-03-15 US disclosed