SCHEMBL7010602

SCHEMBL7010602

Cc1cc(C(=O)NCCn2ccnn2)c(C=C2C(=O)Nc3cccc(-c4ccc(F)cc4)c32)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.43
PDGFRB P09619 9/20 0.43
FGFR1 P11362 6/20 0.43
ALK Q9UM73 4/20 0.41
EGFR P00533 2/20 0.40
PDGFRA P16234 2/20 0.40
PRKAA1 Q13131 8/20 0.40
PRKAA2 P54646 7/20 0.40
TLK2 Q86UE8 3/20 0.40
HDAC3 O15379 2/20 0.38
HDAC4 P56524 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC7 Q8WUI4 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC10 Q969S8 2/20 0.38
HDAC11 Q96DB2 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC9 Q9UKV0 2/20 0.38
HDAC5 Q9UQL6 2/20 0.38

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
SCHEMBL7094200 0.93 ALK (0.39) KDRPDGFRBFGFR1ALKEGFR
SCHEMBL7094064 0.90 DGAT2 (0.43) KDRPDGFRBFGFR1ALKEGFR
SCHEMBL6321854 0.79 ALK (0.48) KDRPDGFRBFGFR1ALKPDGFRA
SCHEMBL6321849 0.79 ALK (0.48) KDRPDGFRBFGFR1ALKPDGFRA
SCHEMBL7006025 0.79 LRRK2 (0.52) KDRPDGFRBFGFR1ALKEGFR
SCHEMBL7095986 0.78 CHEK1 (0.50) KDRPDGFRBFGFR1ALKTLK2
SCHEMBL7004752 0.77 PDGFRB (0.53) KDRPDGFRBFGFR1TLK2LCK
SCHEMBL6326926 0.77 PDGFRB (0.49) KDRPDGFRBFGFR1EGFRPDGFRA
SCHEMBL6324172 0.76 SMYD2 (0.47) KDRPDGFRBFGFR1ALKTLK2
SCHEMBL6321944 0.76 ALK (0.42) KDRPDGFRBFGFR1ALKEGFR

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