SCHEMBL4771434

SCHEMBL4771434

CC(C)(C)Cc1cc2ncnc(Oc3ccc(N)c(Cl)c3)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.37
KDR P35968 14/20 0.36
FGFR1 P11362 3/20 0.33
KIT P10721 2/20 0.33
PDGFRA P16234 2/20 0.33
FLT1 P17948 2/20 0.33
FLT4 P35916 2/20 0.33
RET P07949 2/20 0.33
CSF1R P07333 1/20 0.33
FLT3 P36888 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
SCHEMBL4282301 0.82 EGFR (0.41) EGFRKDRRET
SCHEMBL4766245 0.81 KDM4C (0.34) KDRFGFR1KITPDGFRAFLT1
SCHEMBL4283173 0.81 KDR (0.39) EGFRKDRKITPDGFRAFLT1
SCHEMBL4771430 0.80 EGFR (0.37) EGFRKDRFGFR1KITPDGFRA
SCHEMBL4290591 0.74 DYRK1A (0.45) EGFRKDR
SCHEMBL15960748 0.69 KDR (0.53) EGFRKDRKITPDGFRAFLT1
SCHEMBL4284980 0.69 KDR (0.56) KDRFGFR1
SCHEMBL4292419 0.69 EGFR (0.36) EGFRKDRKITPDGFRAFLT1
SCHEMBL4668514 0.68 KDR (0.74) EGFRKDRKITPDGFRAFLT1
SCHEMBL31616965 0.68 KDR (0.74) EGFRKDRKITPDGFRAFLT1

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-1904498-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-04-02 EP disclosed
WO-2007004749-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 WO disclosed