SCHEMBL6089776

SCHEMBL6089776

CN1CCN(Cc2c(C=C3C(=O)NN=C3c3cncnc3)[nH]c3c2CCCC3)CC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 0.43
KDR P35968 13/20 0.43
FGFR1 P11362 11/20 0.43
LCK P06239 10/20 0.43
FYN P06241 10/20 0.43
YES1 P07947 10/20 0.43
PDGFRB P09619 10/20 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
SCHEMBL6089760 1.00 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6088713 0.93 KDR (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6088723 0.93 KDR (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6089912 0.92 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6089922 0.92 SRC (0.41) SRCKDRFGFR1LCKFYN
SCHEMBL6089751 0.90 SRC (0.42) SRCKDRFGFR1LCKFYN
SCHEMBL6089746 0.90 SRC (0.42) SRCKDRFGFR1LCKFYN
SCHEMBL6089694 0.89 KDR (0.50) SRCKDRFGFR1LCKFYN
SCHEMBL6089678 0.89 KDR (0.50) SRCKDRFGFR1LCKFYN
SCHEMBL6091112 0.88 SRC (0.43) 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