SCHEMBL7987022

SCHEMBL7987022

Cc1cccc(Cl)c1-c1c(OCCN2CCOCC2)c(NCCCN2CCOCC2)cc2c1nc(N)c1cncn12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.52
FGFR1 P11362 5/20 0.44
SRC P12931 4/20 0.44
PDPK1 O15530 2/20 0.43
FGFR2 P21802 1/20 0.42
FGFR4 P22455 1/20 0.42
FGFR3 P22607 1/20 0.42
POLB P06746 1/20 0.42
KDR P35968 1/20 0.39

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
SCHEMBL7983395 0.94 LCK (0.47) LCKFGFR1SRCPDPK1FGFR2
SCHEMBL7981496 0.93 LCK (0.47) LCKFGFR1SRCPDPK1FGFR2
SCHEMBL7982990 0.93 LCK (0.55) LCKFGFR1SRCPDPK1FGFR2
SCHEMBL7981212 0.92 LCK (0.48) LCKSRCPDPK1POLB
SCHEMBL7983212 0.83 LCK (0.60) LCKFGFR1SRCFGFR2FGFR4
SCHEMBL7983881 0.80 FGFR1 (0.47) LCKFGFR1SRCFGFR2FGFR4
SCHEMBL7984582 0.80 LCK (0.61) LCKSRCPDPK1POLB
SCHEMBL7983651 0.78 LCK (0.59) LCKFGFR1SRCPDPK1FGFR2
SCHEMBL7980019 0.77 LCK (0.52) LCKFGFR1SRCFGFR2FGFR4
SCHEMBL4041190 0.75 LCK (0.51) LCKFGFR1SRCPDPK1FGFR2

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
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US claimed
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US disclosed