SCHEMBL17200871

SCHEMBL17200871

COc1ccc(-c2cnc3c(c2)c(-c2ccccc2)cn3S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.51
ELAVL1 Q15717 3/20 0.51
PTPN11 Q06124 9/20 0.51
HTR6 P50406 3/20 0.48
DRD2 P14416 1/20 0.48
HTR2A P28223 1/20 0.48
HTR7 P34969 1/20 0.48
BRD4 O60885 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL13745818 0.90 KDR (0.51) KDRELAVL1PTPN11HTR6DRD2
SCHEMBL13669265 0.87 GAK (0.54) PTPN11HTR6BRD4
SCHEMBL13745697 0.87 BRD4 (0.61) KDRELAVL1PTPN11HTR6DRD2
SCHEMBL13746471 0.86 PTPN11 (0.43) KDRELAVL1PTPN11HTR6DRD2
SCHEMBL15821553 0.85 HTR6 (0.46) ELAVL1PTPN11HTR6DRD2HTR2A
SCHEMBL2750994 0.81 PDPK1 (0.54) PTPN11HTR6BRD4
SCHEMBL1487576 0.80 HTR6 (0.45) ELAVL1PTPN11HTR6BRD4
SCHEMBL4169651 0.80 PTPN11 (0.56) PTPN11BRD4
SCHEMBL4171120 0.79 PTPN11 (0.75) PTPN11BRD4
SCHEMBL4160192 0.79 PTPN11 (0.53) ELAVL1PTPN11HTR6DRD2HTR2A

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-9447093-B2 3,5-diarylazaindoles as DYRK1A protein inhibitors for the treatment of cognitive deficiencies associated with Down's syndrome and with Alzheimer's disease CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2016-09-20 US disclosed
US-20150307492-A1 3,5-Diarylazaindoles as DYRK1A Protein Inhibitors for the Treatment of Cognitive Deficiencies Associated with Down's Syndrome and with Alzheimer's Disease CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-10-29 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-20150307492-A1 3,5-Diarylazaindoles as DYRK1A Protein Inhibitors for the Treatment of Cognitive Deficiencies Associated with Down's Syndrome and with Alzheimer's Disease DYRK1A, DYRK3, DYRK2 KDR 4793/4885ELAVL1 3944/4885PTPN11 2452/4885

“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.