SCHEMBL7096211

SCHEMBL7096211

CCN(CC)CCNC(=O)c1cc(C)c(C=C2C(=O)Nc3cccc(-c4cccc(Cl)c4)c32)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.56
PDGFRB P09619 8/20 0.56
EGFR P00533 6/20 0.56
ERBB2 P04626 1/20 0.55
PRKAA1 Q13131 10/20 0.53
PRKAA2 P54646 8/20 0.53
FGFR1 P11362 4/20 0.53
PDGFRA P16234 2/20 0.53
KIT P10721 2/20 0.53
NEK2 P51955 2/20 0.53
MELK Q14680 2/20 0.53
FLT3 P36888 3/20 0.46
PLK4 O00444 2/20 0.46
DCLK1 O15075 2/20 0.46
PDPK1 O15530 2/20 0.46
DAPK3 O43293 2/20 0.46
ROCK2 O75116 2/20 0.46
RPS6KA5 O75582 2/20 0.46
RPS6KA4 O75676 2/20 0.46
MAP4K4 O95819 2/20 0.46

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
SCHEMBL7100124 0.93 KDR (0.57) KDRPDGFRBEGFRERBB2PRKAA1
SCHEMBL7095008 0.91 KDR (0.53) KDRPDGFRBEGFRERBB2PRKAA1
SCHEMBL6404884 0.91 KDR (0.57) KDRPDGFRBEGFRERBB2PRKAA1
SCHEMBL7009559 0.88 KDR (0.58) KDRPDGFRBEGFRERBB2PRKAA1
SCHEMBL14448818 0.84 KDR (0.71) KDRPDGFRBEGFRPRKAA1PRKAA2
SCHEMBL6319769 0.82 KDR (0.50) KDRPDGFRBEGFRERBB2FGFR1
SCHEMBL6319763 0.82 KDR (0.50) KDRPDGFRBEGFRERBB2FGFR1
SCHEMBL6327494 0.81 CHEK1 (0.46) KDRPDGFRBEGFRPRKAA1PRKAA2
SCHEMBL7096348 0.78 KDR (0.75) KDRPDGFRBEGFRPRKAA1PRKAA2
SCHEMBL16137754 0.78 KDR (0.75) KDRPDGFRBEGFRPRKAA1PRKAA2

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-1349852-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES Sugen, Inc. (US) 2003-10-08 EP disclosed
WO-2002055517-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES CUI JINGRONG (US) 2002-07-18 WO disclosed