SCHEMBL19953372

SCHEMBL19953372

COc1cc(-c2cccn2C(=O)OC(C)(C)C)c(OC)cc1-c1cccn1C(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.51
HSP90AB1 P08238 1/20 0.51
PIK3R1 P27986 1/20 0.48
PIK3CA P42336 1/20 0.48
MET P08581 1/20 0.48
AXL P30530 1/20 0.48
MERTK Q12866 1/20 0.48
BUB1 O43683 1/20 0.41
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
ATR Q13535 1/20 0.39
BCHE P06276 1/20 0.38
TNK2 Q07912 1/20 0.38
SUV39H2 Q9H5I1 7/20 0.37
PDE4B Q07343 2/20 0.36
STS P08842 1/20 0.34
TNFSF11 O14788 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL14770871 0.91 HSP90AA1 (0.49) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL19718909 0.88 MET (0.47) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL6040619 0.88 HSP90AA1 (0.44) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL14770848 0.87 HSP90AA1 (0.47) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL31518171 0.85 JAK2 (0.45) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL5991785 0.85 HSP90AA1 (0.44) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL31533137 0.84 HSP90AA1 (0.54) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL3693171 0.84 HSP90AA1 (0.45) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL22036737 0.83 HSP90AA1 (0.53) HSP90AA1HSP90AB1PIK3R1PIK3CAMET
SCHEMBL15417099 0.82 HSP90AA1 (0.53) HSP90AA1HSP90AB1PIK3R1PIK3CAMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510076-A1 CONDUCTING POLYMERS AND USES THEREOF Auckland UniServices Limited (NZ) 2019-07-17 EP disclosed
US-20190194386-A1 Conducting Polymers and Uses Thereof AUCKLAND UNISERVICES LIMITED (NZ) 2019-06-27 US disclosed
WO-2018047101-A1 CONDUCTING POLYMERS AND USES THEREOF AUCKLAND UNISERVICES LIMITED (NZ) 2018-03-15 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-20190194386-A1 Conducting Polymers and Uses Thereof POLI, PARG, PARN HSP90AA1 2077/4885HSP90AB1 3251/4885PIK3R1 3376/4885

“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.