SCHEMBL3267645

SCHEMBL3267645

COc1ccc2c(c1)/C(=C/c1[nH]c(C)c(C(=O)O)c1C)C(=O)N2

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 2/20 0.73
LRRK2 Q5S007 2/20 0.69
FLT3 P36888 10/20 0.68
KDR P35968 8/20 0.68
FLT4 P35916 4/20 0.68
KIT P10721 2/20 0.68
AURKB Q96GD4 5/20 0.66
PDGFRB P09619 5/20 0.66
AURKA O14965 1/20 0.66
MET P08581 1/20 0.66
AURKC Q9UQB9 1/20 0.66
RET P07949 2/20 0.62
FGFR1 P11362 4/20 0.59
CCNE1 P24864 1/20 0.56
CDK2 P24941 1/20 0.56
ABL1 P00519 1/20 0.54

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
SCHEMBL2111085 0.91 KDR (0.77) ALKLRRK2FLT3KDRFLT4
SCHEMBL4489518 0.88 ALK (0.71) ALKLRRK2FLT3KDRFLT4
SCHEMBL4489516 0.88 ALK (0.71) ALKLRRK2FLT3KDRFLT4
SCHEMBL3273838 0.86 ALK (0.79) ALKLRRK2FLT3KDRFLT4
SCHEMBL16486529 0.85 ALK (0.78) ALKFLT3KDRFLT4KIT
SCHEMBL16490745 0.85 ALK (0.78) ALKFLT3KDRFLT4KIT
SCHEMBL18631714 0.84 ALK (0.76) ALKLRRK2FLT3KDRFLT4
SCHEMBL2112712 0.84 ALK (0.76) ALKLRRK2FLT3KDRFLT4
SCHEMBL31726830 0.84 ALK (0.76) ALKLRRK2FLT3KDRFLT4
SCHEMBL3723130 0.84 ALK (0.76) ALKFLT3KDRFLT4KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029580-B1 NOVEL INDOL-PYRROL DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE AND INFLAMMATORY DISEASES SCHEBO BIOTECH AG (DE) 2010-06-16 EP claimed
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
EP-2035582-A2 BIOMARKERS FOR THE PROGRESSION OF ALZHEIMER'S DISEASE Novartis AG (CH) 2009-03-18 EP disclosed
WO-2009030270-A1 DIHYDROINDOLE DERIVATIVES USEFUL IN PARKINSON'S DISEASE NOVARTIS AG (CH) 2009-03-12 WO disclosed
WO-2007149798-A2 BIOMARKERS FOR THE PROGRESSION OF ALZHEIMER'S DISEASE NOVARTIS AG (CH) 2007-12-27 WO 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-20100035251-A1 BioMarkers for the Progression of Alzheimer's Disease LRRK2, PSEN2, CLK2 ALK 4140/4885LRRK2 1/4885FLT3 3804/4885

“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.