SCHEMBL2111085

SCHEMBL2111085

COc1ccc2c(c1)NC(=O)/C2=C\c1[nH]c(C)c(C(=O)O)c1C

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.77
FLT3 P36888 11/20 0.77
FLT4 P35916 6/20 0.77
KIT P10721 3/20 0.77
AURKB Q96GD4 6/20 0.75
PDGFRB P09619 6/20 0.75
AURKA O14965 1/20 0.75
MET P08581 1/20 0.75
AURKC Q9UQB9 1/20 0.75
FGFR1 P11362 5/20 0.70
ALK Q9UM73 1/20 0.64
LRRK2 Q5S007 1/20 0.58
EGFR P00533 1/20 0.58

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
SCHEMBL3267645 0.91 ALK (0.73) KDRFLT3FLT4KITAURKB
SCHEMBL4460869 0.90 KDR (0.68) KDRFLT3FLT4KITAURKB
SCHEMBL3717720 0.90 KDR (0.68) KDRFLT3FLT4KITAURKB
SCHEMBL3718713 0.89 KDR (0.73) KDRFLT3FLT4KITAURKB
SCHEMBL4461111 0.89 KDR (0.73) KDRFLT3FLT4KITAURKB
SCHEMBL3273702 0.86 FLT3 (0.76) KDRFLT3FLT4KITAURKB
SCHEMBL3268878 0.84 KDR (0.76) KDRFLT3FLT4KITAURKB
SCHEMBL3268874 0.84 ALK (0.83) KDRFLT3FLT4KITAURKB
SCHEMBL6585195 0.84 KDR (0.67) KDRFLT3FLT4KITAURKB
SCHEMBL6587955 0.84 ALK (0.83) KDRFLT3FLT4KITAURKB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158656-B2 2-indolinone derivatives as multi-target protein kinase inhibitors and histone deacetylase inhibitors SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2012-04-17 US disclosed
EP-2029580-B1 NOVEL INDOL-PYRROL DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE AND INFLAMMATORY DISEASES SCHEBO BIOTECH AG (DE) 2010-06-16 EP disclosed
US-20100035251-A1 BioMarkers for the Progression of Alzheimer's Disease HE YUNSHENG 2010-02-11 US disclosed
US-20090298886-A1 2-INDOLINONE DERIVATIVES AS MULTI-TARGET PROTEIN KINASE INHIBITORS AND HISTONE DEACETYLASE INHIBITORS CHIPSCREEN BIOSCIENCES, LTD. (CN) 2009-12-03 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 (2 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-20090298886-A1 2-INDOLINONE DERIVATIVES AS MULTI-TARGET PROTEIN KINASE INHIBITORS AND HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC2, HDAC3 KDR 2274/4885FLT3 1894/4885FLT4 3618/4885
US-20100035251-A1 BioMarkers for the Progression of Alzheimer's Disease LRRK2, PSEN2, CLK2 KDR 1446/4885FLT3 3804/4885FLT4 3601/4885

“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.