SCHEMBL4073928

SCHEMBL4073928

CCN(CC)C(=O)C1(c2cc(-c3ccc(NC(=O)Nc4cccc(C(F)(F)F)c4)cc3)c3cnn(C)c3n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.48
CSF1R P07333 5/20 0.48
FLT1 P17948 5/20 0.48
FLT3 P36888 5/20 0.48
KIT P10721 4/20 0.48
FLT4 P35916 4/20 0.48
LCK P06239 4/20 0.48
FYN P06241 4/20 0.48
NTRK1 P04629 4/20 0.48
NTRK2 Q16620 4/20 0.48
AURKB Q96GD4 4/20 0.48
LYN P07948 3/20 0.48
SRC P12931 3/20 0.48
BLK P51451 3/20 0.48
JAK2 O60674 3/20 0.48
EPHA2 P29317 3/20 0.48
MAP4K2 Q12851 3/20 0.48
TAOK1 Q7L7X3 3/20 0.48
HIPK2 Q9H2X6 3/20 0.48
MKNK2 Q9HBH9 3/20 0.48

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
SCHEMBL2817549 0.92 FLT3 (0.48) KDRCSF1RFLT1FLT3KIT
SCHEMBL12973426 0.88 KDR (0.51) KDRCSF1RFLT1FLT3KIT
SCHEMBL2816690 0.88 CSF1R (0.48) KDRCSF1RFLT1FLT3KIT
SCHEMBL2821063 0.86 KDR (0.63) KDRCSF1RFLT1FLT3KIT
SCHEMBL2817544 0.86 CSF1R (0.47) KDRCSF1RFLT1FLT3KIT
SCHEMBL12973411 0.85 IDH2 (0.49) KDRCSF1RFLT1FLT3KIT
SCHEMBL12973413 0.84 LMNA (0.46) KDRCSF1RFLT1FLT3KIT
SCHEMBL12973419 0.82 MEN1 (0.53) KDRCSF1RFLT1FLT3KIT
SCHEMBL12973414 0.82 KDR (0.45) KDRFLT3KITAURKAALK
SCHEMBL4078557 0.81 KDR (0.55) KDRCSF1RFLT1FLT3KIT

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
EP-2061790-A1 SUBSTITUTED AMINOPYRAZOLOPYRIDINES AND SALTS THEREOF, THEIR PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Bayer Schering Pharma Aktiengesellschaft (DE) 2009-05-27 EP claimed
WO-2007144204-A1 SUBSTITUTED AMINOPYRAZOLOPYRIDINES AND SALTS THEREOF, THEIR PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-12-21 WO claimed