SCHEMBL22927004

SCHEMBL22927004

CC(C)(O)C(C)(C)OBc1cccc2c1ccc1c3ccccc3sc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.35
ALOX5 P09917 1/20 0.35
GPR3 P46089 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33
PTPN22 Q9Y2R2 1/20 0.33
APEX1 P27695 1/20 0.32
MAPT P10636 3/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HCRTR1 O43613 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL25140477 0.92 PARP14 (0.36) PARP14ALOX5GPR3PTPN7DUSP3
SCHEMBL18164670 0.90 MAPT (0.37) PARP14ALOX5GPR3PTPN7DUSP3
SCHEMBL25472187 0.86
SCHEMBL22302490 0.85 APEX1 (0.35) PARP14ALOX5GPR3PTPN7DUSP3
SCHEMBL25472400 0.85 CLK1 (0.32) KDM4E
SCHEMBL22135451 0.83 PTPN7 (0.39) PARP14ALOX5GPR3PTPN7DUSP3
SCHEMBL24713808 0.83
SCHEMBL22249828 0.81 GPR3 (0.35) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL27335303 0.80 PARP14 (0.38) PARP14ALOX5
SCHEMBL22311750 0.80 APEX1 (0.33) PARP14ALOX5GPR3PTPN7DUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210028373-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-01-28 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-20210028373-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TERT, TELO2, LIMS1 PARP14 1094/4885ALOX5 956/4885GPR3 4796/4885

“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.