SCHEMBL14423908

SCHEMBL14423908

O=C(Nc1ccc(Oc2ncnc3[nH]c(-c4ccc(OCC(O)CN5CCCC5)cc4)cc23)cc1F)NC1CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.44
FLT1 P17948 10/20 0.44
FLT4 P35916 10/20 0.44
CCR1 P32246 4/20 0.42
KIT P10721 1/20 0.41
KCNH2 Q12809 3/20 0.40
PAK1 Q13153 1/20 0.39
FLT3 P36888 1/20 0.38
MAPK1 P28482 1/20 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
SCHEMBL1896037 1.00 KDR (0.44) KDRFLT1FLT4CCR1KIT
SCHEMBL1896040 1.00 KDR (0.44) KDRFLT1FLT4CCR1KIT
SCHEMBL1891779 0.92 KDR (0.53) KDRFLT1FLT4CCR1KCNH2
SCHEMBL1895332 0.92 KDR (0.53) KDRFLT1FLT4CCR1KCNH2
SCHEMBL1890518 0.86 KDR (0.38) KDRFLT1FLT4KITPAK1
SCHEMBL1890519 0.86 KDR (0.38) KDRFLT1FLT4KITPAK1
SCHEMBL4714048 0.81 KIT (0.37) KITMAPK1
SCHEMBL1893413 0.80 KDR (0.42) KDRFLT1FLT4CCR1KCNH2
SCHEMBL1893412 0.80 KDR (0.42) KDRFLT1FLT4CCR1KCNH2
SCHEMBL1892317 0.80 KDR (0.61) KDRFLT1FLT4

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
US-7253286-B2 Urea derivatives containing aromatic or heteroaromatic rings, useful as prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI CO., LTD (JP) 2007-08-07 US disclosed
US-7253286-B2 Urea derivatives containing aromatic or heteroaromatic rings, useful as prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI CO., LTD (JP) 2007-08-07 US disclosed