SCHEMBL3812985

SCHEMBL3812985

CC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc32)c1CCC(=O)O.CC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3ccc(S(=O)(=O)Cc4c(Cl)cccc4Cl)cc32)c1CCC(=O)N1CCN(C)CC1.CC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3ccc(S(=O)(=O)Cc4c(Cl)cccc4Cl)cc32)c1CCC(=O)O.CC(=O)c1c(C)[nH]c(C=C2C(=O)Nc3ccc(S(=O)(=O)N4CCc5ccccc54)cc32)c1CCC(=O)N1CCN(C)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.57
AURKA O14965 12/20 0.51
AURKB Q96GD4 11/20 0.51
SRC P12931 3/20 0.47
FGFR1 P11362 2/20 0.45
CDK2 P24941 2/20 0.45
KDR P35968 2/20 0.45
PTK2B Q14289 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
PLK4 O00444 1/20 0.45
RIOK3 O14730 1/20 0.45
CASK O14936 1/20 0.45
GAK O14976 1/20 0.45
DCLK1 O15075 1/20 0.45
EPHB6 O15197 1/20 0.45
MAP3K13 O43283 1/20 0.45
MAP3K7 O43318 1/20 0.45
NUAK1 O60285 1/20 0.45

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
SCHEMBL3808724 0.86 MET (0.75) METAURKAAURKBSRCFGFR1
SCHEMBL3805989 0.86 MET (0.75) METAURKAAURKBSRCFGFR1
SCHEMBL3794353 0.85 SRC (0.60) METAURKAAURKBSRCFGFR1
SCHEMBL3794357 0.85 SRC (0.60) METAURKAAURKBSRCFGFR1
SCHEMBL3798305 0.84 AURKA (0.64) METAURKAAURKBSRCFGFR1
SCHEMBL3798297 0.84 AURKA (0.64) METAURKAAURKBSRCFGFR1
SCHEMBL3797737 0.83 AURKA (0.72) METAURKAAURKBSRCFGFR1
SCHEMBL3797740 0.83 AURKA (0.72) METAURKAAURKBSRCFGFR1
SCHEMBL3801007 0.80 AURKA (0.66) METAURKAAURKBSRCFGFR1
SCHEMBL3801013 0.80 AURKA (0.66) METAURKAAURKBSRCFGFR1

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-7897602-B2 Indolinone compounds as kinase inhibitors DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2011-03-01 US disclosed
US-20100179146-A1 Indolinone Compounds as Kinase Inhibitors DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2010-07-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100179146-A1 Indolinone Compounds as Kinase Inhibitors CDK2, MAP3K19, MAP3K20 MET 1698/4885AURKA 96/4885AURKB 69/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.