SCHEMBL6089569

SCHEMBL6089569

O=C1NN=C(c2cccnc2)C1=Cc1[nH]c2c(c1CN1CCOCC1)CCCC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 9/20 0.49
KDR P35968 7/20 0.49
FGFR1 P11362 6/20 0.49
LCK P06239 3/20 0.49
FYN P06241 3/20 0.49
YES1 P07947 3/20 0.49
PDGFRB P09619 4/20 0.40
ALK Q9UM73 1/20 0.36
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
KIT P10721 1/20 0.34
SLC2A1 P11166 1/20 0.34
PIK3CD O00329 1/20 0.33

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
SCHEMBL6089561 1.00 SRC (0.49) SRCKDRFGFR1LCKFYN
SCHEMBL6090351 0.93 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6090354 0.93 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6087790 0.92 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6087795 0.92 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6089746 0.90 SRC (0.42) SRCKDRFGFR1LCKFYN
SCHEMBL6089751 0.90 SRC (0.42) SRCKDRFGFR1LCKFYN
SCHEMBL6090509 0.90 KDR (0.51) SRCKDRFGFR1LCKFYN
SCHEMBL6090525 0.90 KDR (0.51) SRCKDRFGFR1LCKFYN
SCHEMBL6089694 0.90 KDR (0.50) SRCKDRFGFR1LCKFYN

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-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed